methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/analysis/cgMethanolSPH.trr methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/analysis/log.txt methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/analysis/orientation.dat methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/analysis/rdf.cg-sim.CGC-CGC.log methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/analysis/rdf.cg-sim.CGC-CGC.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/analysis/rdf.cg-sim.CGC-CGO.log methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/analysis/rdf.cg-sim.CGC-CGO.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/analysis/rdf.cg-sim.CGO-CGO.log methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/analysis/rdf.cg-sim.CGO-CGO.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/analysis/rdf.cg-sim.SPH-CGC.log methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/analysis/rdf.cg-sim.SPH-CGC.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/analysis/rdf.cg-sim.SPH-CGO.log methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/analysis/rdf.cg-sim.SPH-CGO.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/analysis/run.sh methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/cgMethanolSPH.edr methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/cgMethanolSPH.gro methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/cgMethanolSPH.mdp methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/cgMethanolSPH.prod.log methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/cgMethanolSPH.top methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/cgMethanolSPH.tpr methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/cgMethanolSPH.trr methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/confout.gro methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/grompp.log methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/mdout-cgMethanolSPH.mdp methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/mdrun.log methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/qsub.sh methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/reduce_frames.sh methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/repulse2.o1033897 methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/run.sh methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/run_gmx.sh methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/start/ methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/start/cgMethanolSPH.gro methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/start/cgMethanolSPH.mdp methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/start/cgMethanolSPH.top methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/start/qsub.sh methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/start/reduce_frames.sh methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/start/run_gmx.sh methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/start/table.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/start/table_CGC_CGC.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/start/table_CGC_CGO.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/start/table_CGC_SPH.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/start/table_CGO_CGO.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/start/table_CGO_SPH.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/start/table_index.ndx methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/state.cpt methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/state_prev.cpt methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/table.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/table_CGC_CGC.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/table_CGC_CGO.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/table_CGC_SPH.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/table_CGO_CGO.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/table_CGO_SPH.xvg methanol-ref/CG-sims/using-structures/prod-sims/2-site/repulsive2/table_index.ndx methanol-ref/CGFF/ methanol-ref/CGFF/using-forces/ methanol-ref/CGFF/using-forces/No-Ref-Pot/ methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/ methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/ methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/ methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-L-cgMethanol.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-L-cgMethanol.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-b-cgMethanol.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-b-cgMethanol.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-b-cgMethanol.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-b-cgMethanol.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-f-cgMethanol.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-f-cgMethanol.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-f-cgMethanol.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-f-cgMethanol.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-g-cgMethanol.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-g-cgMethanol.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-g_cnt-cgMethanol.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-g_cnt-cgMethanol.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/CGM-CGM-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/cgMethanol.1.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/cgMethanol.2.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/cgff-M_1.o1015329 methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/Methanol/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/ methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-L-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-L-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-b-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-b-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-b-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-b-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-f-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-f-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-f-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-f-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-g-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-g-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-g_cnt-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-g_cnt-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-L-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-L-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-b-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-b-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-b-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-b-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-f-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-f-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-f-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-f-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-g-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-g-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-g_cnt-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-g_cnt-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/cgMethanolSPH.1.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/cgMethanolSPH.2.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/cgff-MSPH_1.o1015330 methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/ methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-L-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-L-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-b-cgMethanolSPH2.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-b-cgMethanolSPH2.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-b-cgMethanolSPH2.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-b-cgMethanolSPH2.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-f-cgMethanolSPH2.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-f-cgMethanolSPH2.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-f-cgMethanolSPH2.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-f-cgMethanolSPH2.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-g-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-g-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-g_cnt-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-g_cnt-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-L-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-L-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-b-cgMethanolSPH2.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-b-cgMethanolSPH2.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-b-cgMethanolSPH2.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-b-cgMethanolSPH2.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-f-cgMethanolSPH2.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-f-cgMethanolSPH2.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-f-cgMethanolSPH2.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-f-cgMethanolSPH2.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-g-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-g-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-g_cnt-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-g_cnt-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/cgMethanolSPH2.1.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/cgMethanolSPH2.2.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/cgff-MSPH2_1.o1015331 methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/1-site/MethanolSPH2/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/ methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/ methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-L-cgMethanol.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-L-cgMethanol.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-b-cgMethanol.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-b-cgMethanol.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-b-cgMethanol.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-b-cgMethanol.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-f-cgMethanol.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-f-cgMethanol.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-f-cgMethanol.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-f-cgMethanol.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-g-cgMethanol.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-g-cgMethanol.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-g_cnt-cgMethanol.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-g_cnt-cgMethanol.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-L-cgMethanol.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-L-cgMethanol.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-b-cgMethanol.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-b-cgMethanol.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-b-cgMethanol.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-b-cgMethanol.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-f-cgMethanol.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-f-cgMethanol.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-f-cgMethanol.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-f-cgMethanol.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-g-cgMethanol.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-g-cgMethanol.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-g_cnt-cgMethanol.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-g_cnt-cgMethanol.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGC-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-L-cgMethanol.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-L-cgMethanol.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-b-cgMethanol.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-b-cgMethanol.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-b-cgMethanol.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-b-cgMethanol.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-f-cgMethanol.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-f-cgMethanol.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-f-cgMethanol.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-f-cgMethanol.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-g-cgMethanol.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-g-cgMethanol.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-g_cnt-cgMethanol.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-g_cnt-cgMethanol.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/CGO-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/cgMethanol.1.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/cgMethanol.2.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/cgff-M_2.o1015332 methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc10.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc11.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc12.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc13.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc14.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc15.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc8.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/log_proc9.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/Methanol/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/ methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-L-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-L-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-b-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-b-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-b-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-b-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-f-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-f-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-f-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-f-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-g-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-g-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-g_cnt-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-g_cnt-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-L-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-L-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-b-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-b-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-b-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-b-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-f-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-f-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-f-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-f-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-g-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-g-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-g_cnt-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-g_cnt-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-L-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-L-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-b-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-b-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-b-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-b-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-f-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-f-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-f-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-f-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-g-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-g-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-g_cnt-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-g_cnt-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-L-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-L-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-b-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-b-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-b-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-b-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-f-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-f-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-f-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-f-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-g-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-g-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-g_cnt-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-g_cnt-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-L-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-L-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-b-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-b-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-b-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-b-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-f-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-f-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-f-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-f-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-g-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-g-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-g_cnt-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-g_cnt-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/cgMethanolSPH.1.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/cgMethanolSPH.2.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/cgff-MSPH_2.o1015334 methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc10.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc11.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc12.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc13.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc14.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc15.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc8.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/log_proc9.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/ methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-L-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-L-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-b-cgMethanolSPH2.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-b-cgMethanolSPH2.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-b-cgMethanolSPH2.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-b-cgMethanolSPH2.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-f-cgMethanolSPH2.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-f-cgMethanolSPH2.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-f-cgMethanolSPH2.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-f-cgMethanolSPH2.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-g-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-g-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-g_cnt-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-g_cnt-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-L-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-L-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-b-cgMethanolSPH2.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-b-cgMethanolSPH2.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-b-cgMethanolSPH2.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-b-cgMethanolSPH2.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-f-cgMethanolSPH2.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-f-cgMethanolSPH2.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-f-cgMethanolSPH2.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-f-cgMethanolSPH2.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-g-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-g-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-g_cnt-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-g_cnt-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-L-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-L-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-b-cgMethanolSPH2.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-b-cgMethanolSPH2.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-b-cgMethanolSPH2.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-b-cgMethanolSPH2.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-f-cgMethanolSPH2.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-f-cgMethanolSPH2.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-f-cgMethanolSPH2.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-f-cgMethanolSPH2.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-g-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-g-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-g_cnt-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-g_cnt-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-L-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-L-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-b-cgMethanolSPH2.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-b-cgMethanolSPH2.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-b-cgMethanolSPH2.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-b-cgMethanolSPH2.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-f-cgMethanolSPH2.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-f-cgMethanolSPH2.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-f-cgMethanolSPH2.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-f-cgMethanolSPH2.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-g-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-g-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-g_cnt-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-g_cnt-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-L-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-L-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-b-cgMethanolSPH2.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-b-cgMethanolSPH2.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-b-cgMethanolSPH2.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-b-cgMethanolSPH2.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-f-cgMethanolSPH2.1.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-f-cgMethanolSPH2.1.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-f-cgMethanolSPH2.2.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-f-cgMethanolSPH2.2.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-g-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-g-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-g_cnt-cgMethanolSPH2.1.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-g_cnt-cgMethanolSPH2.2.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/cgMethanolSPH2.1.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/cgMethanolSPH2.2.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/cgff-MSPH2_2.o1015335 methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc10.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc11.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc12.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc13.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc14.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc15.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc8.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/log_proc9.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/10ns/2-site/MethanolSPH2/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/ methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/ABOUT methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/ methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGC-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGC-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGC-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGC-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGC-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGC-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGC-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGC-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGC-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGC-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGC-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGC-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGC-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGC-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGO-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGO-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGO-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGO-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGO-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGO-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/CGO-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/cgMethanol.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/cgff_M1.o1019001 methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc10.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc11.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc12.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc13.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc14.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc15.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc8.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/log_proc9.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol1/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/ methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGO-BondStretch-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGO-BondStretch-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGO-BondStretch-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGO-BondStretch-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGO-BondStretch-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGO-BondStretch-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGO-BondStretch-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGC-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGO-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGO-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGO-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGO-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGO-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGO-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/CGO-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/cgMethanol.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/cgff-M_2.o1019002 methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc10.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc11.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc12.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc13.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc14.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc15.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc8.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/log_proc9.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/2500frames/Methanol2/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/ methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/ methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/ methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/CGM-CGM-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/CGM-CGM-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/CGM-CGM-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/CGM-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/CGM-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/CGM-CGM-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/CGM-CGM-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/cgMethanol.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/cgff-M_1.o1006414 methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/Methanol/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/ methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/CGM-CGM-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/SPH-CGM-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/cgMethanolSPH.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/cgff-MSPH_1.o1006416 methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/ methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/CGM-CGM-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/SPH-CGM-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/cgMethanolSPH2.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/cgff-MSPH2_1.o1006417 methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/1-site/MethanolSPH2/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/ methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/ methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGC-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGC-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGC-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGC-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGC-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGC-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGC-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGC-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGC-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGC-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGC-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGC-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGC-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGC-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGO-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGO-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGO-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGO-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGO-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGO-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/CGO-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/cgMethanolSPH.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/cgff-MSPH_2.o1008050 methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc10.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc11.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc12.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc13.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc14.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc15.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc8.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/log_proc9.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/temp/ methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/temp/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/temp/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/temp/fit-f.SPH-CGC.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH/temp/fit-f.SPH-CGO.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/ methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGC-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGC-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGC-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGC-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGC-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGC-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGC-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGC-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGC-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGC-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGC-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGC-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGC-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGC-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGO-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGO-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGO-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGO-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGO-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGO-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/CGO-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/cgMethanolSPH2.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/cgff-MSPH2_2.o1008051 methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc10.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc11.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc12.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc13.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc14.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc15.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc8.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/log_proc9.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site-larger-bins/MethanolSPH2/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/ methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/ methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGC-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGC-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGC-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGC-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGC-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGC-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGC-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGC-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGC-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGC-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGC-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGC-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGC-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGC-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGO-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGO-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGO-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGO-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGO-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGO-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/CGO-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/cgMethanol.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/cgff-M_2.o1006418 methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc10.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc11.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc12.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc13.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc14.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc15.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc8.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/log_proc9.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/Methanol/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/ methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGC-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGC-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/CGO-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/cgMethanolSPH.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/cgff-MSPH_2.o1006419 methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc10.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc11.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc12.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc13.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc14.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc15.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc8.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/log_proc9.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/temp/ methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/temp/CGC-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/temp/CGC-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/temp/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/temp/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/temp/fit-SPH-CGC.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH/temp/fit-SPH-CGO.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/ methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGC-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGC-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/CGO-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/cgMethanolSPH2.tpr methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/cgff-MSPH2_2.o1006420 methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/inp.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_global.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc0.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc1.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc10.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc11.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc12.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc13.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc14.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc15.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc2.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc3.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc4.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc5.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc6.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc7.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc8.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/log_proc9.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/out.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/par.txt methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/2-site/MethanolSPH2/qsub.sh methanol-ref/CGFF/using-forces/No-Ref-Pot/5ns/Compare-bin-widths.agr methanol-ref/CGFF/using-forces/RefPot/ methanol-ref/CGFF/using-forces/RefPot/1-site/ methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/ methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/CGM-CGM-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-L-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-L-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-b-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-b-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-b-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-b-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-f-cgMethanolSPH.1.forces.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-f-cgMethanolSPH.1.struct.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-f-cgMethanolSPH.2.forces.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-f-cgMethanolSPH.2.struct.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-g-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-g-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-g_cnt-cgMethanolSPH.1.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-g_cnt-cgMethanolSPH.2.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/SPH-CGM-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/cgMethanolSPH.1.tpr methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/cgMethanolSPH.1.trr methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/cgMethanolSPH.2.tpr methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/cgMethanolSPH.2.trr methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/cgff-ms.o1019247 methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/inp.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_global.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc0.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc1.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc10.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc11.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc12.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc13.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc14.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc15.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc2.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc3.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc4.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc5.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc6.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc7.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc8.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/log_proc9.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/out.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/par.txt methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/qsub.sh methanol-ref/CGFF/using-forces/RefPot/1-site/1-site/ref.txt methanol-ref/CGFF/using-forces/RefPot/1-site/ref_forces/ methanol-ref/CGFF/using-forces/RefPot/1-site/ref_forces/CGM-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/1-site/ref_forces/CGM-CGM-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/1-site/ref_forces/run.sh methanol-ref/CGFF/using-forces/RefPot/1-site/tables/ methanol-ref/CGFF/using-forces/RefPot/1-site/tables/CGM-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/1-site/tables/SPH-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/1-site/tables/do_table.sh methanol-ref/CGFF/using-forces/RefPot/1-site/tables/f-CGM_CGM.dat methanol-ref/CGFF/using-forces/RefPot/1-site/tables/f-CGM_SPH.dat methanol-ref/CGFF/using-forces/RefPot/1-site/tables/p-CGM_CGM.dat methanol-ref/CGFF/using-forces/RefPot/1-site/tables/p-CGM_SPH.dat methanol-ref/CGFF/using-forces/RefPot/1-site/tables/run.sh methanol-ref/CGFF/using-forces/RefPot/1-site/tables/smooth-f.CGM-CGM.dat methanol-ref/CGFF/using-forces/RefPot/1-site/tables/smooth-f.CGM-SPH.dat methanol-ref/CGFF/using-forces/RefPot/1-site/tables/table_CGM_CGM.xvg methanol-ref/CGFF/using-forces/RefPot/1-site/tables/table_CGM_SPH.xvg methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/ methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/ methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/ methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/CGC-CGC-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/CGC-CGO-BondStretch-L-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/CGC-CGO-BondStretch-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/CGC-CGO-BondStretch-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/CGC-CGO-BondStretch-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/CGC-CGO-BondStretch-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/CGC-CGO-BondStretch-g-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/CGC-CGO-BondStretch-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/CGC-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/CGO-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/bond.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/cgMethanolSPH.tpr methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/cgff.o1019211 methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/inp.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_global.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc0.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc1.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc10.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc11.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc12.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc13.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc14.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc15.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc2.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc3.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc4.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc5.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc6.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc7.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc8.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/log_proc9.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/out.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/par.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/qsub.sh methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin1/ref.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/ methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/CGC-CGC-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/CGC-CGO-BondStretch-L-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/CGC-CGO-BondStretch-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/CGC-CGO-BondStretch-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/CGC-CGO-BondStretch-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/CGC-CGO-BondStretch-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/CGC-CGO-BondStretch-g-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/CGC-CGO-BondStretch-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/CGC-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/CGO-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/bond.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/cgMethanolSPH.tpr methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/cgff.o1019210 methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/inp.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_global.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc0.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc1.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc10.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc11.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc12.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc13.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc14.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc15.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc2.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc3.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc4.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc5.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc6.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc7.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc8.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/log_proc9.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/out.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/par.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/qsub.sh methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin2/ref.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/ methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/CGC-CGC-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/CGC-CGO-BondStretch-L-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/CGC-CGO-BondStretch-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/CGC-CGO-BondStretch-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/CGC-CGO-BondStretch-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/CGC-CGO-BondStretch-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/CGC-CGO-BondStretch-g-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/CGC-CGO-BondStretch-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/CGC-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/CGO-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/bond.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/cgMethanolSPH.tpr methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/cgff.o1019093 methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/inp.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_global.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc0.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc1.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc10.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc11.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc12.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc13.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc14.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc15.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc2.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc3.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc4.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc5.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc6.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc7.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc8.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/log_proc9.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/out.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/par.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/qsub.sh methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin3/ref.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/ methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/CGC-CGC-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/CGC-CGO-BondStretch-L-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/CGC-CGO-BondStretch-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/CGC-CGO-BondStretch-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/CGC-CGO-BondStretch-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/CGC-CGO-BondStretch-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/CGC-CGO-BondStretch-g-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/CGC-CGO-BondStretch-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/CGC-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/CGO-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/bond.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/cgMethanolSPH.tpr methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/cgff.o1019094 methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/inp.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_global.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc0.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc1.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc10.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc11.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc12.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc13.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc14.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc15.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc2.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc3.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc4.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc5.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc6.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc7.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc8.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/log_proc9.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/out.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/par.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/qsub.sh methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin4/ref.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/ methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/CGC-CGC-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/CGC-CGO-BondStretch-L-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/CGC-CGO-BondStretch-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/CGC-CGO-BondStretch-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/CGC-CGO-BondStretch-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/CGC-CGO-BondStretch-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/CGC-CGO-BondStretch-g-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/CGC-CGO-BondStretch-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/CGC-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/CGO-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/bond.ref.dat methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/cgMethanolSPH.tpr methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/cgff.o1019095 methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/inp.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_global.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc0.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc1.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc10.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc11.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc12.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc13.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc14.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc15.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc2.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc3.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc4.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc5.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc6.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc7.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc8.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/log_proc9.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/out.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/par.txt methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/qsub.sh methanol-ref/CGFF/using-forces/RefPot/Mar12.2010-test/bin/bin5/ref.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/ methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/ methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/10000frames.o1018362 methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/CGC-CGC-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/CGC-CGO-BondStretch-L-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/CGC-CGO-BondStretch-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/CGC-CGO-BondStretch-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/CGC-CGO-BondStretch-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/CGC-CGO-BondStretch-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/CGC-CGO-BondStretch-g-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/CGC-CGO-BondStretch-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/CGC-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/CGO-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/bond.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/cgMethanolSPH.10000.tpr methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/cgMethanolSPH.10000.trr methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/inp.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_global.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc0.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc1.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc10.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc11.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc12.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc13.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc14.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc15.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc2.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc3.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc4.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc5.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc6.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc7.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc8.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/log_proc9.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/out.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/par.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/qsub.sh methanol-ref/CGFF/using-forces/RefPot/dr0.010/10000frames/ref.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/ methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/25000frames.o1018364 methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/CGC-CGC-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/CGC-CGO-BondStretch-L-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/CGC-CGO-BondStretch-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/CGC-CGO-BondStretch-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/CGC-CGO-BondStretch-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/CGC-CGO-BondStretch-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/CGC-CGO-BondStretch-g-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/CGC-CGO-BondStretch-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/CGC-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/CGO-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/bond.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/cgMethanolSPH.2500.tpr methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/cgMethanolSPH.2500.trr methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/inp.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_global.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc0.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc1.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc10.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc11.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc12.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc13.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc14.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc15.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc2.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc3.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc4.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc5.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc6.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc7.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc8.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/log_proc9.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/out.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/par.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/qsub.sh methanol-ref/CGFF/using-forces/RefPot/dr0.010/2500frames/ref.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/ methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/5000frames.o1018363 methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/CGC-CGC-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/CGC-CGO-BondStretch-L-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/CGC-CGO-BondStretch-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/CGC-CGO-BondStretch-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/CGC-CGO-BondStretch-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/CGC-CGO-BondStretch-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/CGC-CGO-BondStretch-g-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/CGC-CGO-BondStretch-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/CGC-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/CGO-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/bond.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/cgMethanolSPH.5000.tpr methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/cgMethanolSPH.5000.trr methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/inp.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_global.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc0.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc1.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc10.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc11.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc12.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc13.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc14.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc15.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc2.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc3.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc4.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc5.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc6.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc7.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc8.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/log_proc9.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/out.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/par.txt methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/qsub.sh methanol-ref/CGFF/using-forces/RefPot/dr0.010/5000frames/ref.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/ methanol-ref/CGFF/using-forces/RefPot/dr0.020/10000frames.o1018373 methanol-ref/CGFF/using-forces/RefPot/dr0.020/CGC-CGC-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/CGC-CGO-BondStretch-L-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/CGC-CGO-BondStretch-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/CGC-CGO-BondStretch-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/CGC-CGO-BondStretch-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/CGC-CGO-BondStretch-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/CGC-CGO-BondStretch-g-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/CGC-CGO-BondStretch-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/CGC-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/CGO-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/bond.ref.dat methanol-ref/CGFF/using-forces/RefPot/dr0.020/cgMethanolSPH.10000.tpr methanol-ref/CGFF/using-forces/RefPot/dr0.020/cgMethanolSPH.10000.trr methanol-ref/CGFF/using-forces/RefPot/dr0.020/inp.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_global.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc0.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc1.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc10.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc11.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc12.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc13.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc14.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc15.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc2.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc3.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc4.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc5.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc6.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc7.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc8.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/log_proc9.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/out.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/par.txt methanol-ref/CGFF/using-forces/RefPot/dr0.020/qsub.sh methanol-ref/CGFF/using-forces/RefPot/dr0.020/ref.txt methanol-ref/CGFF/using-forces/RefPot/reference-forces/ methanol-ref/CGFF/using-forces/RefPot/reference-forces/ABOUT methanol-ref/CGFF/using-forces/RefPot/reference-forces/CGC-CGC-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/reference-forces/CGC-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/reference-forces/CGO-CGO-f.ref.dat methanol-ref/CGFF/using-forces/RefPot/reference-forces/bond/ methanol-ref/CGFF/using-forces/RefPot/reference-forces/bond/bond.ref.dat methanol-ref/CGFF/using-forces/RefPot/reference-forces/bond/run.sh methanol-ref/CGFF/using-forces/RefPot/reference-forces/bond/test-p.dat methanol-ref/CGFF/using-forces/RefPot/reference-forces/extrapolate-forces/ methanol-ref/CGFF/using-forces/RefPot/reference-forces/extrapolate-forces/CGC-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/reference-forces/extrapolate-forces/CGC-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/reference-forces/extrapolate-forces/CGO-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/reference-forces/extrapolate-forces/run.sh methanol-ref/CGFF/using-forces/RefPot/reference-forces/original/ methanol-ref/CGFF/using-forces/RefPot/reference-forces/original/CGC-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/reference-forces/original/CGC-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/reference-forces/original/CGO-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/reference-forces/original/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-forces/RefPot/reference-forces/original/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-structures/ methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/ methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/ methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/CGM-CGM-f.ref.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/SPH-CGM-NB_PairInter-L-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/SPH-CGM-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/SPH-CGM-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/SPH-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/SPH-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/SPH-CGM-NB_PairInter-g-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/SPH-CGM-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/cgMethanolSPH.tpr methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/cgff-ms1.o1033832 methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/inp.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_global.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc0.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc1.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc10.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc11.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc12.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc13.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc14.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc15.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc2.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc3.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc4.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc5.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc6.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc7.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc8.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/log_proc9.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/out.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/par.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/qsub.sh methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH/ref.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/ methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/CGM-CGM-f.ref.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/SPH-CGM-NB_PairInter-L-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/SPH-CGM-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/SPH-CGM-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/SPH-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/SPH-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/SPH-CGM-NB_PairInter-g-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/SPH-CGM-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/cgMethanolSPH2.tpr methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/cgff-ms2.o1033833 methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/inp.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_global.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc0.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc1.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc10.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc11.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc12.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc13.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc14.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc15.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc2.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc3.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc4.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc5.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc6.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc7.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc8.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/log_proc9.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/out.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/par.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/qsub.sh methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/MethanolSPH2/ref.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/cgff-pure-methanol-forces/ methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/cgff-pure-methanol-forces/cut-structure-cgff-force/ methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/cgff-pure-methanol-forces/cut-structure-cgff-force/CGM-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/cgff-pure-methanol-forces/cut-structure-cgff-force/smooth-f.CGM-CGM.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/cgff-pure-methanol-forces/original/ methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/cgff-pure-methanol-forces/original/CGM-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site.ref-calc/cgff-pure-methanol-forces/original/CGM-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/ methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/CGFF-1Site-Methanol-Forces.agr methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/CGM-CGM-NB_PairInter-L-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/CGM-CGM-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/CGM-CGM-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/CGM-CGM-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/CGM-CGM-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/CGM-CGM-NB_PairInter-g-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/CGM-CGM-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/cgMethanol.tpr methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/cgff-M_1.o1025669 methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/inp.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/log.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/log_global.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/log_proc0.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/log_proc1.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/log_proc2.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/log_proc3.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/log_proc4.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/log_proc5.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/log_proc6.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/log_proc7.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/out.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/par.txt methanol-ref/CGFF/using-structures/cgff.Methanol.1-site/qsub.sh methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/ methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/ methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/CGC-CGC-f.ref.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/CGC-CGO-BondStretch-L-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/CGC-CGO-BondStretch-b-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/CGC-CGO-BondStretch-b-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/CGC-CGO-BondStretch-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/CGC-CGO-BondStretch-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/CGC-CGO-BondStretch-g-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/CGC-CGO-BondStretch-g_cnt-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/CGC-CGO-f.ref.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/CGO-CGO-f.ref.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/bond.ref.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/cgMethanolSPH.tpr methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/cgff-2-ms1.o1033834 methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/inp.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_global.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc0.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc1.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc10.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc11.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc12.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc13.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc14.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc15.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc2.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc3.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc4.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc5.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc6.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc7.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc8.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/log_proc9.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/out.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/par.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/qsub.sh methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH/ref.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/ methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/CGC-CGC-f.ref.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/CGC-CGO-BondStretch-L-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/CGC-CGO-BondStretch-b-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/CGC-CGO-BondStretch-b-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/CGC-CGO-BondStretch-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/CGC-CGO-BondStretch-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/CGC-CGO-BondStretch-g-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/CGC-CGO-BondStretch-g_cnt-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/CGC-CGO-f.ref.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/CGO-CGO-f.ref.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/SPH-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/SPH-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/SPH-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/SPH-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/SPH-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/SPH-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/SPH-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/SPH-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/SPH-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/SPH-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/SPH-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/SPH-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/SPH-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/SPH-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/bond.ref.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/cgMethanolSPH2.tpr methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/cgff-2-ms2.o1033837 methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/inp.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_global.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc0.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc1.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc10.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc11.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc12.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc13.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc14.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc15.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc2.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc3.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc4.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc5.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc6.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc7.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc8.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/log_proc9.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/out.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/par.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/qsub.sh methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/MethanolSPH2/ref.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/bond-forces/ methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/bond-forces/bond.CGC-CGO-f.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/bond-forces/bond.CGC-CGO-p.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/bond-forces/run.sh methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/cut-cgff-ybg-forces/ methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/cut-cgff-ybg-forces/CGC-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/cut-cgff-ybg-forces/CGC-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/cut-cgff-ybg-forces/CGO-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/cut-cgff-ybg-forces/smooth-f.CGC-CGC.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/cut-cgff-ybg-forces/smooth-f.CGC-CGO.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/cut-cgff-ybg-forces/smooth-f.CGO-CGO.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/original-cgff-forces/ methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/original-cgff-forces/CGC-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/original-cgff-forces/CGC-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/original-cgff-forces/CGC-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/original-cgff-forces/CGC-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/original-cgff-forces/CGO-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site.ref-calc/original-cgff-forces/CGO-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/ methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGC-CGC-NB_PairInter-L-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGC-CGC-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGC-CGC-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGC-CGC-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGC-CGC-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGC-CGC-NB_PairInter-g-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGC-CGC-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGC-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGC-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGC-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGC-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGC-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGC-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGC-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGO-CGO-NB_PairInter-L-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGO-CGO-NB_PairInter-b-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGO-CGO-NB_PairInter-b-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGO-CGO-NB_PairInter-f-total.forces.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGO-CGO-NB_PairInter-f-total.struct.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGO-CGO-NB_PairInter-g-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/CGO-CGO-NB_PairInter-g_cnt-total.dat methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/cgMethanol.tpr methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/cgff-M_2.o1025670 methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/inp.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/log.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/log_global.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/log_proc0.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/log_proc1.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/log_proc2.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/log_proc3.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/log_proc4.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/log_proc5.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/log_proc6.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/log_proc7.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/out.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/par.txt methanol-ref/CGFF/using-structures/cgff.Methanol.2-site/qsub.sh methanol-ref/Jun.2010/ methanol-ref/Jun.2010/cgff-ref/ methanol-ref/Jun.2010/cgff-ref/1000frames/ methanol-ref/Jun.2010/cgff-ref/1000frames/CGM-1000.ref.o1221314 methanol-ref/Jun.2010/cgff-ref/1000frames/L.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/1000frames/L.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/L.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/b_forces.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/1000frames/b_forces.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/b_forces.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/b_struct.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/1000frames/b_struct.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/b_struct.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/cgMethanolSPH.1000.tpr methanol-ref/Jun.2010/cgff-ref/1000frames/cgMethanolSPH.1000.trr methanol-ref/Jun.2010/cgff-ref/1000frames/dg_dz.total.Pair_Interaction.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/1000frames/dg_dz.total.Pair_Interaction.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/dg_dz.total.Pair_Interaction.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/dg_dz.total.Pair_Interaction.SPH-CGC.dat methanol-ref/Jun.2010/cgff-ref/1000frames/dg_dz.total.Pair_Interaction.SPH-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/f_forces.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/1000frames/f_forces.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/f_forces.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/f_struct.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/1000frames/f_struct.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/f_struct.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/g.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/1000frames/g.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/g.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/g_cnt.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/1000frames/g_cnt.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/g_cnt.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/1000frames/inp.txt methanol-ref/Jun.2010/cgff-ref/1000frames/log.txt methanol-ref/Jun.2010/cgff-ref/1000frames/out.total.txt methanol-ref/Jun.2010/cgff-ref/1000frames/par.txt methanol-ref/Jun.2010/cgff-ref/1000frames/qsub.sh methanol-ref/Jun.2010/cgff-ref/1000frames/ref.CGC-SPH-f.dat methanol-ref/Jun.2010/cgff-ref/1000frames/ref.CGO-SPH-f.dat methanol-ref/Jun.2010/cgff-ref/1000frames/ref.txt methanol-ref/Jun.2010/cgff-ref/1000frames/summarize_input.txt methanol-ref/Jun.2010/cgff-ref/1000frames/test_num_soln.dat methanol-ref/Jun.2010/cgff-ref/2000frames/ methanol-ref/Jun.2010/cgff-ref/2000frames/CGM-2000.ref.o1221316 methanol-ref/Jun.2010/cgff-ref/2000frames/L.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/2000frames/L.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/L.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/b_forces.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/2000frames/b_forces.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/b_forces.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/b_struct.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/2000frames/b_struct.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/b_struct.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/cgMethanolSPH.2000.tpr methanol-ref/Jun.2010/cgff-ref/2000frames/cgMethanolSPH.2000.trr methanol-ref/Jun.2010/cgff-ref/2000frames/dg_dz.total.Pair_Interaction.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/2000frames/dg_dz.total.Pair_Interaction.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/dg_dz.total.Pair_Interaction.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/dg_dz.total.Pair_Interaction.SPH-CGC.dat methanol-ref/Jun.2010/cgff-ref/2000frames/dg_dz.total.Pair_Interaction.SPH-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/f_forces.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/2000frames/f_forces.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/f_forces.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/f_struct.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/2000frames/f_struct.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/f_struct.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/g.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/2000frames/g.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/g.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/g_cnt.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/2000frames/g_cnt.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/g_cnt.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/2000frames/inp.txt methanol-ref/Jun.2010/cgff-ref/2000frames/log.txt methanol-ref/Jun.2010/cgff-ref/2000frames/out.total.txt methanol-ref/Jun.2010/cgff-ref/2000frames/par.txt methanol-ref/Jun.2010/cgff-ref/2000frames/qsub.sh methanol-ref/Jun.2010/cgff-ref/2000frames/ref.CGC-SPH-f.dat methanol-ref/Jun.2010/cgff-ref/2000frames/ref.CGO-SPH-f.dat methanol-ref/Jun.2010/cgff-ref/2000frames/ref.txt methanol-ref/Jun.2010/cgff-ref/2000frames/summarize_input.txt methanol-ref/Jun.2010/cgff-ref/2000frames/test_num_soln.dat methanol-ref/Jun.2010/cgff-ref/5000frames/ methanol-ref/Jun.2010/cgff-ref/5000frames/CGM-5000.ref.o1221319 methanol-ref/Jun.2010/cgff-ref/5000frames/L.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/5000frames/L.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/L.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/b_forces.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/5000frames/b_forces.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/b_forces.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/b_struct.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/5000frames/b_struct.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/b_struct.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/cgMethanolSPH.5000.tpr methanol-ref/Jun.2010/cgff-ref/5000frames/cgMethanolSPH.5000.trr methanol-ref/Jun.2010/cgff-ref/5000frames/dg_dz.total.Pair_Interaction.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/5000frames/dg_dz.total.Pair_Interaction.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/dg_dz.total.Pair_Interaction.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/dg_dz.total.Pair_Interaction.SPH-CGC.dat methanol-ref/Jun.2010/cgff-ref/5000frames/dg_dz.total.Pair_Interaction.SPH-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/f_forces.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/5000frames/f_forces.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/f_forces.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/f_struct.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/5000frames/f_struct.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/f_struct.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/g.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/5000frames/g.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/g.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/g_cnt.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff-ref/5000frames/g_cnt.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/g_cnt.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff-ref/5000frames/inp.txt methanol-ref/Jun.2010/cgff-ref/5000frames/log.txt methanol-ref/Jun.2010/cgff-ref/5000frames/out.total.txt methanol-ref/Jun.2010/cgff-ref/5000frames/par.txt methanol-ref/Jun.2010/cgff-ref/5000frames/qsub.sh methanol-ref/Jun.2010/cgff-ref/5000frames/ref.CGC-SPH-f.dat methanol-ref/Jun.2010/cgff-ref/5000frames/ref.CGO-SPH-f.dat methanol-ref/Jun.2010/cgff-ref/5000frames/ref.txt methanol-ref/Jun.2010/cgff-ref/5000frames/summarize_input.txt methanol-ref/Jun.2010/cgff-ref/5000frames/test_num_soln.dat methanol-ref/Jun.2010/cgff/ methanol-ref/Jun.2010/cgff/1000frames/ methanol-ref/Jun.2010/cgff/1000frames/CGM-1000.2.o1221221 methanol-ref/Jun.2010/cgff/1000frames/L.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/L.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/L.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/L.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/L.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/b_forces.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/b_forces.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/b_forces.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/b_forces.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/b_forces.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/b_struct.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/b_struct.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/b_struct.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/b_struct.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/b_struct.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/cgMethanolSPH.1000.tpr methanol-ref/Jun.2010/cgff/1000frames/cgMethanolSPH.1000.trr methanol-ref/Jun.2010/cgff/1000frames/dg_dz.total.Pair_Interaction.CGC-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/dg_dz.total.Pair_Interaction.CGC-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/dg_dz.total.Pair_Interaction.CGO-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/dg_dz.total.Pair_Interaction.SPH-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/dg_dz.total.Pair_Interaction.SPH-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/f_forces.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/f_forces.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/f_forces.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/f_forces.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/f_forces.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/f_struct.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/f_struct.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/f_struct.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/f_struct.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/f_struct.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/g.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/g.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/g.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/g.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/g.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/g_cnt.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/g_cnt.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/g_cnt.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/g_cnt.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/1000frames/g_cnt.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/1000frames/inp.txt methanol-ref/Jun.2010/cgff/1000frames/log.txt methanol-ref/Jun.2010/cgff/1000frames/out.total.txt methanol-ref/Jun.2010/cgff/1000frames/par.txt methanol-ref/Jun.2010/cgff/1000frames/qsub.sh methanol-ref/Jun.2010/cgff/1000frames/summarize_input.txt methanol-ref/Jun.2010/cgff/1000frames/test_num_soln.dat methanol-ref/Jun.2010/cgff/2000frames/ methanol-ref/Jun.2010/cgff/2000frames/CGM-2000.2.o1221223 methanol-ref/Jun.2010/cgff/2000frames/L.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/L.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/L.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/L.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/L.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/b_forces.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/b_forces.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/b_forces.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/b_forces.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/b_forces.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/b_struct.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/b_struct.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/b_struct.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/b_struct.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/b_struct.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/cgMethanolSPH.2000.tpr methanol-ref/Jun.2010/cgff/2000frames/cgMethanolSPH.2000.trr methanol-ref/Jun.2010/cgff/2000frames/dg_dz.total.Pair_Interaction.CGC-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/dg_dz.total.Pair_Interaction.CGC-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/dg_dz.total.Pair_Interaction.CGO-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/dg_dz.total.Pair_Interaction.SPH-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/dg_dz.total.Pair_Interaction.SPH-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/f_forces.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/f_forces.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/f_forces.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/f_forces.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/f_forces.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/f_struct.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/f_struct.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/f_struct.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/f_struct.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/f_struct.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/g.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/g.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/g.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/g.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/g.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/g_cnt.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/g_cnt.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/g_cnt.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/g_cnt.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/2000frames/g_cnt.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/2000frames/inp.txt methanol-ref/Jun.2010/cgff/2000frames/log.txt methanol-ref/Jun.2010/cgff/2000frames/out.total.txt methanol-ref/Jun.2010/cgff/2000frames/par.txt methanol-ref/Jun.2010/cgff/2000frames/qsub.sh methanol-ref/Jun.2010/cgff/2000frames/summarize_input.txt methanol-ref/Jun.2010/cgff/2000frames/test_num_soln.dat methanol-ref/Jun.2010/cgff/5000frames/ methanol-ref/Jun.2010/cgff/5000frames/CGM-5000.2.o1221227 methanol-ref/Jun.2010/cgff/5000frames/L.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/L.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/L.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/L.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/L.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/b_forces.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/b_forces.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/b_forces.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/b_forces.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/b_forces.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/b_struct.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/b_struct.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/b_struct.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/b_struct.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/b_struct.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/cgMethanolSPH.5000.tpr methanol-ref/Jun.2010/cgff/5000frames/cgMethanolSPH.5000.trr methanol-ref/Jun.2010/cgff/5000frames/dg_dz.total.Pair_Interaction.CGC-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/dg_dz.total.Pair_Interaction.CGC-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/dg_dz.total.Pair_Interaction.CGO-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/dg_dz.total.Pair_Interaction.SPH-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/dg_dz.total.Pair_Interaction.SPH-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/f_forces.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/f_forces.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/f_forces.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/f_forces.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/f_forces.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/f_struct.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/f_struct.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/f_struct.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/f_struct.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/f_struct.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/g.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/g.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/g.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/g.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/g.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/g_cnt.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/g_cnt.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/g_cnt.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/g_cnt.Pair_Interaction.total.SPH-CGC.dat methanol-ref/Jun.2010/cgff/5000frames/g_cnt.Pair_Interaction.total.SPH-CGO.dat methanol-ref/Jun.2010/cgff/5000frames/inp.txt methanol-ref/Jun.2010/cgff/5000frames/log.txt methanol-ref/Jun.2010/cgff/5000frames/out.total.txt methanol-ref/Jun.2010/cgff/5000frames/par.txt methanol-ref/Jun.2010/cgff/5000frames/qsub.sh methanol-ref/Jun.2010/cgff/5000frames/summarize_input.txt methanol-ref/Jun.2010/cgff/5000frames/test_num_soln.dat methanol-ref/Jun.2010/ignoreSPH/ methanol-ref/Jun.2010/ignoreSPH/L.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/ignoreSPH/L.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/ignoreSPH/L.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/ignoreSPH/NoSPH.o1221336 methanol-ref/Jun.2010/ignoreSPH/b_forces.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/ignoreSPH/b_forces.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/ignoreSPH/b_forces.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/ignoreSPH/b_struct.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/ignoreSPH/b_struct.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/ignoreSPH/b_struct.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/ignoreSPH/cgMethanolSPH.1000.tpr methanol-ref/Jun.2010/ignoreSPH/cgMethanolSPH.1000.trr methanol-ref/Jun.2010/ignoreSPH/dg_dz.total.Pair_Interaction.CGC-CGC.dat methanol-ref/Jun.2010/ignoreSPH/dg_dz.total.Pair_Interaction.CGC-CGO.dat methanol-ref/Jun.2010/ignoreSPH/dg_dz.total.Pair_Interaction.CGO-CGO.dat methanol-ref/Jun.2010/ignoreSPH/dg_dz.total.Pair_Interaction.SPH-CGC.dat methanol-ref/Jun.2010/ignoreSPH/dg_dz.total.Pair_Interaction.SPH-CGO.dat methanol-ref/Jun.2010/ignoreSPH/f_forces.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/ignoreSPH/f_forces.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/ignoreSPH/f_forces.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/ignoreSPH/f_struct.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/ignoreSPH/f_struct.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/ignoreSPH/f_struct.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/ignoreSPH/g.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/ignoreSPH/g.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/ignoreSPH/g.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/ignoreSPH/g_cnt.Pair_Interaction.total.CGC-CGC.dat methanol-ref/Jun.2010/ignoreSPH/g_cnt.Pair_Interaction.total.CGC-CGO.dat methanol-ref/Jun.2010/ignoreSPH/g_cnt.Pair_Interaction.total.CGO-CGO.dat methanol-ref/Jun.2010/ignoreSPH/inp.txt methanol-ref/Jun.2010/ignoreSPH/log.txt methanol-ref/Jun.2010/ignoreSPH/out.total.txt methanol-ref/Jun.2010/ignoreSPH/par.txt methanol-ref/Jun.2010/ignoreSPH/qsub.sh methanol-ref/Jun.2010/ignoreSPH/summarize_input.txt methanol-ref/Jun.2010/ignoreSPH/test_num_soln.dat methanol-ref/Jun.2010/plots/ methanol-ref/Jun.2010/plots/CGM-b-convergence.agr methanol-ref/Jun.2010/plots/CGM-b-convergence.diff.agr methanol-ref/Jun.2010/plots/CGM-forces-convergence.agr methanol-ref/Jun.2010/plots/CGM-forces-differences.agr methanol-ref/Jun.2010/plots/ConvergTest.agr methanol-ref/Jun.2010/plots/IgnoreSphTest.agr methanol-ref/Jun.2010/plots/IgnoreSphTestDiff.agr methanol-ref/MAITI/ methanol-ref/MAITI/1c.gro methanol-ref/MAITI/box.gro methanol-ref/MAITI/index.ndx methanol-ref/MAITI/maiti_par.itp methanol-ref/MAITI/nvt_old.mdp methanol-ref/MAITI/plate_0c-1c.gro methanol-ref/MAITI/plate_0c-1c.itp methanol-ref/MAITI/plate_0c-1c.top methanol-ref/MAITI/prod_old.mdp methanol-ref/MAITI/qsub.sh methanol-ref/MAITI/reverse.sh methanol-ref/MAITI/run methanol-ref/MAITI/run-tut.sh methanol-ref/MAITI/run0-tut.sh methanol-ref/MAITI/run0.sh methanol-ref/MAITI/table.xvg methanol-ref/MAITI/table_PLAT_SOL.xvg methanol-ref/MAITI/tablep.xvg methanol-ref/MAITI/tablep_PLAT_SOL.xvg methanol-ref/Mar17.2010/ methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/ methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/1-site/ methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/1-site/CGMap.sh methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/1-site/cgMethanol.gro methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/1-site/cgMethanol.mdp methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/1-site/cgMethanol.top methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/1-site/cgMethanol.tpr methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/1-site/cgMethanol.trr methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/1-site/mapMethanol.top methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/1-site/mdout.mdp methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/2-site/ methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/2-site/CGMap.sh methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/2-site/cgMethanol.gro methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/2-site/cgMethanol.mdp methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/2-site/cgMethanol.top methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/2-site/cgMethanol.tpr methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/2-site/cgMethanol.trr methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/2-site/mapMethanol.top methanol-ref/Mar17.2010/AA-mapping-1000frames-Methanol/2-site/mdout.mdp methanol-ref/Mar17.2010/AA-traj-1000frames-Methanol/ methanol-ref/Mar17.2010/AA-traj-1000frames-Methanol/Methanol.ref.gro methanol-ref/Mar17.2010/AA-traj-1000frames-Methanol/Methanol.ref.log