cgff_production_calculations/hep/cgheptane.gro cgff_production_calculations/hep/cgheptane.mdp cgff_production_calculations/hep/cgheptane.top cgff_production_calculations/hep/cgheptane.tpr cgff_production_calculations/hep/distance.xvg cgff_production_calculations/hep/f_forces.Angle.total.Angle_CT-CM-CT.dat cgff_production_calculations/hep/f_forces.BondStretch.total.Bond_CT-CM.dat cgff_production_calculations/hep/f_forces.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/f_forces.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/f_forces.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/f_forces_coeff.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/f_forces_coeff.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/f_forces_coeff.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/f_struct.Angle.total.Angle_CT-CM-CT.dat cgff_production_calculations/hep/f_struct.BondStretch.total.Bond_CT-CM.dat cgff_production_calculations/hep/f_struct.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/f_struct.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/f_struct.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/f_struct_coeff.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/f_struct_coeff.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/f_struct_coeff.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/g.Angle.total.Angle_CT-CM-CT.dat cgff_production_calculations/hep/g.BondStretch.total.Bond_CT-CM.dat cgff_production_calculations/hep/g.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/g.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/g.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/g_cnt.Angle.total.Angle_CT-CM-CT.dat cgff_production_calculations/hep/g_cnt.BondStretch.total.Bond_CT-CM.dat cgff_production_calculations/hep/g_cnt.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/g_cnt.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/g_cnt.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/g_cnt_coeff.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/g_cnt_coeff.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/g_cnt_coeff.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/g_coeff.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/g_coeff.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/g_coeff.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/get_distros.sh cgff_production_calculations/hep/heptane.1200.cgff/ cgff_production_calculations/hep/heptane.1200.cgff/L.Angle.total.Angle_CT-CM-CT.dat cgff_production_calculations/hep/heptane.1200.cgff/L.BondStretch.total.Bond_CT-CM.dat cgff_production_calculations/hep/heptane.1200.cgff/L.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/heptane.1200.cgff/L.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/heptane.1200.cgff/L.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/heptane.1200.cgff/L_coeff.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/heptane.1200.cgff/L_coeff.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/heptane.1200.cgff/L_coeff.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/heptane.1200.cgff/b_forces.Angle.total.Angle_CT-CM-CT.dat cgff_production_calculations/hep/heptane.1200.cgff/b_forces.BondStretch.total.Bond_CT-CM.dat cgff_production_calculations/hep/heptane.1200.cgff/b_forces.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/heptane.1200.cgff/b_forces.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/heptane.1200.cgff/b_forces.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/heptane.1200.cgff/b_forces_coeff.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/heptane.1200.cgff/b_forces_coeff.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/heptane.1200.cgff/b_forces_coeff.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/heptane.1200.cgff/b_struct.Angle.total.Angle_CT-CM-CT.dat cgff_production_calculations/hep/heptane.1200.cgff/b_struct.BondStretch.total.Bond_CT-CM.dat cgff_production_calculations/hep/heptane.1200.cgff/b_struct.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/heptane.1200.cgff/b_struct.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/heptane.1200.cgff/b_struct.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/heptane.1200.cgff/b_struct_coeff.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/heptane.1200.cgff/b_struct_coeff.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/heptane.1200.cgff/b_struct_coeff.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/heptane.1200.cgff/f_forces.Angle.total.Angle_CT-CM-CT.dat cgff_production_calculations/hep/heptane.1200.cgff/f_forces.BondStretch.total.Bond_CT-CM.dat cgff_production_calculations/hep/heptane.1200.cgff/f_forces.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/heptane.1200.cgff/f_forces.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/heptane.1200.cgff/f_forces.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/heptane.1200.cgff/f_forces_coeff.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/heptane.1200.cgff/f_forces_coeff.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/heptane.1200.cgff/f_forces_coeff.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/heptane.1200.cgff/f_struct.Angle.total.Angle_CT-CM-CT.dat cgff_production_calculations/hep/heptane.1200.cgff/f_struct.BondStretch.total.Bond_CT-CM.dat cgff_production_calculations/hep/heptane.1200.cgff/f_struct.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/heptane.1200.cgff/f_struct.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/heptane.1200.cgff/f_struct.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/heptane.1200.cgff/f_struct_coeff.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/heptane.1200.cgff/f_struct_coeff.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/heptane.1200.cgff/f_struct_coeff.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/heptane.1200.cgff/g.Angle.total.Angle_CT-CM-CT.dat cgff_production_calculations/hep/heptane.1200.cgff/g.BondStretch.total.Bond_CT-CM.dat cgff_production_calculations/hep/heptane.1200.cgff/g.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/heptane.1200.cgff/g.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/heptane.1200.cgff/g.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/heptane.1200.cgff/g_cnt.Angle.total.Angle_CT-CM-CT.dat cgff_production_calculations/hep/heptane.1200.cgff/g_cnt.BondStretch.total.Bond_CT-CM.dat cgff_production_calculations/hep/heptane.1200.cgff/g_cnt.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/heptane.1200.cgff/g_cnt.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/heptane.1200.cgff/g_cnt.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/heptane.1200.cgff/g_cnt_coeff.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/heptane.1200.cgff/g_cnt_coeff.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/heptane.1200.cgff/g_cnt_coeff.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/heptane.1200.cgff/g_coeff.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/heptane.1200.cgff/g_coeff.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/heptane.1200.cgff/g_coeff.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/heptane.1200.cgff/inp.txt cgff_production_calculations/hep/heptane.1200.cgff/log.txt cgff_production_calculations/hep/heptane.1200.cgff/out.total.txt cgff_production_calculations/hep/heptane.1200.cgff/par.txt cgff_production_calculations/hep/heptane.1200.cgff/save.FF.dat cgff_production_calculations/hep/heptane.1200.cgff/save.L.dat cgff_production_calculations/hep/heptane.1200.cgff/save.M.dat cgff_production_calculations/hep/heptane.1200.cgff/save.M2.dat cgff_production_calculations/hep/heptane.1200.cgff/save.Nf.dat cgff_production_calculations/hep/heptane.1200.cgff/save.b_forces.dat cgff_production_calculations/hep/heptane.1200.cgff/save.b_struct.dat cgff_production_calculations/hep/heptane.1200.cgff/save.d2M.dat cgff_production_calculations/hep/heptane.1200.cgff/save.d2b.dat cgff_production_calculations/hep/heptane.1200.cgff/save.g.dat cgff_production_calculations/hep/heptane.1200.cgff/save.g_cnt.dat cgff_production_calculations/hep/heptane.1200.cgff/save.rescale.dat cgff_production_calculations/hep/heptane.1200.cgff/summarize_input.txt cgff_production_calculations/hep/index.ndx cgff_production_calculations/hep/inp.txt cgff_production_calculations/hep/log.txt cgff_production_calculations/hep/map.heptane.461.top cgff_production_calculations/hep/mdout.mdp cgff_production_calculations/hep/out.total.txt cgff_production_calculations/hep/par.txt cgff_production_calculations/hep/polynomial_fit/ cgff_production_calculations/hep/polynomial_fit/CTCT_fit.dat cgff_production_calculations/hep/polynomial_fit/f_forces.Angle.total.Angle_CT-CM-CT.dat cgff_production_calculations/hep/polynomial_fit/f_forces.BondStretch.total.Bond_CT-CM.dat cgff_production_calculations/hep/polynomial_fit/f_forces.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/polynomial_fit/f_forces.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/polynomial_fit/f_forces.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/polynomial_fit/fitting.py cgff_production_calculations/hep/qsub_xv.sh cgff_production_calculations/hep/rdf_CMCM.xvg cgff_production_calculations/hep/rdf_CTCM.xvg cgff_production_calculations/hep/rdf_CTCT.xvg cgff_production_calculations/hep/rdf_HEP.xvg cgff_production_calculations/hep/save.FF.dat cgff_production_calculations/hep/save.L.dat cgff_production_calculations/hep/save.M.dat cgff_production_calculations/hep/save.M2.dat cgff_production_calculations/hep/save.Nf.dat cgff_production_calculations/hep/save.b_forces.dat cgff_production_calculations/hep/save.b_struct.dat cgff_production_calculations/hep/save.d2M.dat cgff_production_calculations/hep/save.d2b.dat cgff_production_calculations/hep/save.g.dat cgff_production_calculations/hep/save.g_cnt.dat cgff_production_calculations/hep/save.rescale.dat cgff_production_calculations/hep/smoothing/ cgff_production_calculations/hep/smoothing/chk_CMCM.bfile cgff_production_calculations/hep/smoothing/chk_CTCM.bfile cgff_production_calculations/hep/smoothing/chk_CTCT.bfile cgff_production_calculations/hep/smoothing/chk_all.sh cgff_production_calculations/hep/smoothing/chk_angle.bfile cgff_production_calculations/hep/smoothing/run.make_gmx4_table.sh cgff_production_calculations/hep/smoothing/smooth_CMCM.bfile cgff_production_calculations/hep/smoothing/smooth_CTCM.bfile cgff_production_calculations/hep/smoothing/smooth_CTCT.bfile cgff_production_calculations/hep/smoothing/smooth_all.sh cgff_production_calculations/hep/smoothing/smooth_angle.bfile cgff_production_calculations/hep/smoothing/smoothed/ cgff_production_calculations/hep/smoothing/smoothed/CMCM_smoothed.dat cgff_production_calculations/hep/smoothing/smoothed/CTCM_smoothed.dat cgff_production_calculations/hep/smoothing/smoothed/CTCT_smoothed.dat cgff_production_calculations/hep/smoothing/smoothed/angle_smoothed.dat cgff_production_calculations/hep/smoothing/splice_all.py cgff_production_calculations/hep/smoothing/spliced/ cgff_production_calculations/hep/smoothing/spliced/CMCM_spliced.dat cgff_production_calculations/hep/smoothing/spliced/CTCM_spliced.dat cgff_production_calculations/hep/smoothing/spliced/CTCT_spliced.dat cgff_production_calculations/hep/smoothing/spliced/angle_spliced.dat cgff_production_calculations/hep/smoothing/table/ cgff_production_calculations/hep/smoothing/table/lammps_angle_CT-CM-CT.table cgff_production_calculations/hep/smoothing/table/lammps_bond_CT-CM.table cgff_production_calculations/hep/smoothing/table/lammps_nb_CMCM.table cgff_production_calculations/hep/smoothing/table/lammps_nb_CTCM.table cgff_production_calculations/hep/smoothing/table/lammps_nb_CTCT.table cgff_production_calculations/hep/smoothing/table/lammps_tables.sh cgff_production_calculations/hep/smoothing/table/table_CM_CM.xvg cgff_production_calculations/hep/smoothing/table/table_CT_CM.xvg cgff_production_calculations/hep/smoothing/table/table_CT_CT.xvg cgff_production_calculations/hep/smoothing/table/table_a0.xvg cgff_production_calculations/hep/smoothing/table/table_b0.xvg cgff_production_calculations/hep/smoothing/thermo_rerun/ cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/ cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/I1_0_HepTol_NPT_rerun.o4209588 cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/cg_pressures.xvg cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/cg_volumes.xvg cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/cgheptane.gro cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/cgheptane.mdp cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/cgheptane.top cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/cgheptane.tpr cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/index.ndx cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/md.log cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/mdout.mdp cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/qsub_xv.sh cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/rerun.edr cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/table_CM_CM.xvg cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/table_CT_CM.xvg cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/table_CT_CT.xvg cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/table_a0.xvg cgff_production_calculations/hep/smoothing/thermo_rerun/1_0_HT/table_b0.xvg cgff_production_calculations/hep/smoothing/trimmed/ cgff_production_calculations/hep/smoothing/trimmed/f_forces.Angle.total.Angle_CT-CM-CT.dat cgff_production_calculations/hep/smoothing/trimmed/f_forces.BondStretch.total.Bond_CT-CM.dat cgff_production_calculations/hep/smoothing/trimmed/f_forces.Pair_Interaction.total.CMCM.dat cgff_production_calculations/hep/smoothing/trimmed/f_forces.Pair_Interaction.total.CTCM.dat cgff_production_calculations/hep/smoothing/trimmed/f_forces.Pair_Interaction.total.CTCT.dat cgff_production_calculations/hep/summarize_input.txt cgff_production_calculations/smoothing/ cgff_production_calculations/smoothing/chk_CBCB.bfile cgff_production_calculations/smoothing/chk_CBCF.bfile cgff_production_calculations/smoothing/chk_CFCF.bfile cgff_production_calculations/smoothing/chk_CMCB.bfile cgff_production_calculations/smoothing/chk_CMCF.bfile cgff_production_calculations/smoothing/chk_CMCM.bfile cgff_production_calculations/smoothing/chk_CTCB.bfile cgff_production_calculations/smoothing/chk_CTCF.bfile cgff_production_calculations/smoothing/chk_CTCM.bfile cgff_production_calculations/smoothing/chk_CTCT.bfile cgff_production_calculations/smoothing/chk_all.sh cgff_production_calculations/smoothing/chk_angle.bfile cgff_production_calculations/smoothing/run.make_gmx4_table.sh cgff_production_calculations/smoothing/smooth_CBCB.bfile cgff_production_calculations/smoothing/smooth_CBCF.bfile cgff_production_calculations/smoothing/smooth_CFCF.bfile cgff_production_calculations/smoothing/smooth_CMCB.bfile cgff_production_calculations/smoothing/smooth_CMCF.bfile cgff_production_calculations/smoothing/smooth_CMCM.bfile cgff_production_calculations/smoothing/smooth_CTCB.bfile cgff_production_calculations/smoothing/smooth_CTCF.bfile cgff_production_calculations/smoothing/smooth_CTCM.bfile cgff_production_calculations/smoothing/smooth_CTCT.bfile cgff_production_calculations/smoothing/smooth_all.sh cgff_production_calculations/smoothing/smooth_angle.bfile cgff_production_calculations/smoothing/smoothed/ cgff_production_calculations/smoothing/smoothed/CBCB_smoothed.dat cgff_production_calculations/smoothing/smoothed/CFCB_smoothed.dat cgff_production_calculations/smoothing/smoothed/CFCF_smoothed.dat cgff_production_calculations/smoothing/smoothed/CMCB_smoothed.dat cgff_production_calculations/smoothing/smoothed/CMCF_smoothed.dat cgff_production_calculations/smoothing/smoothed/CMCM_smoothed.dat cgff_production_calculations/smoothing/smoothed/CTCB_smoothed.dat cgff_production_calculations/smoothing/smoothed/CTCF_smoothed.dat cgff_production_calculations/smoothing/smoothed/CTCM_smoothed.dat cgff_production_calculations/smoothing/smoothed/CTCT_smoothed.dat cgff_production_calculations/smoothing/smoothed/angle_smoothed.dat cgff_production_calculations/smoothing/splice_all.py cgff_production_calculations/smoothing/spliced/ cgff_production_calculations/smoothing/spliced/CBCB_spliced.dat cgff_production_calculations/smoothing/spliced/CFCB_spliced.dat cgff_production_calculations/smoothing/spliced/CFCF_spliced.dat cgff_production_calculations/smoothing/spliced/CMCB_spliced.dat cgff_production_calculations/smoothing/spliced/CMCF_spliced.dat cgff_production_calculations/smoothing/spliced/CMCM_spliced.dat cgff_production_calculations/smoothing/spliced/CTCB_spliced.dat cgff_production_calculations/smoothing/spliced/CTCF_spliced.dat cgff_production_calculations/smoothing/spliced/CTCM_spliced.dat cgff_production_calculations/smoothing/spliced/CTCT_spliced.dat cgff_production_calculations/smoothing/spliced/angle_spliced.dat cgff_production_calculations/smoothing/table/ cgff_production_calculations/smoothing/table/lammps_angle_CT-CM-CT.table cgff_production_calculations/smoothing/table/lammps_bond_CB-CB.table cgff_production_calculations/smoothing/table/lammps_bond_CF-CB.table cgff_production_calculations/smoothing/table/lammps_bond_CT-CM.table cgff_production_calculations/smoothing/table/lammps_nb_CBCB.table cgff_production_calculations/smoothing/table/lammps_nb_CBCM.table cgff_production_calculations/smoothing/table/lammps_nb_CBCT.table cgff_production_calculations/smoothing/table/lammps_nb_CFCB.table cgff_production_calculations/smoothing/table/lammps_nb_CFCF.table cgff_production_calculations/smoothing/table/lammps_nb_CFCM.table cgff_production_calculations/smoothing/table/lammps_nb_CFCT.table cgff_production_calculations/smoothing/table/lammps_nb_CMCM.table cgff_production_calculations/smoothing/table/lammps_nb_CTCM.table cgff_production_calculations/smoothing/table/lammps_nb_CTCT.table cgff_production_calculations/smoothing/table/lammps_tables.sh cgff_production_calculations/smoothing/table/table_CB_CB.xvg cgff_production_calculations/smoothing/table/table_CB_CM.xvg cgff_production_calculations/smoothing/table/table_CB_CT.xvg cgff_production_calculations/smoothing/table/table_CF_CB.xvg cgff_production_calculations/smoothing/table/table_CF_CF.xvg cgff_production_calculations/smoothing/table/table_CF_CM.xvg cgff_production_calculations/smoothing/table/table_CF_CT.xvg cgff_production_calculations/smoothing/table/table_CM_CM.xvg cgff_production_calculations/smoothing/table/table_CT_CM.xvg cgff_production_calculations/smoothing/table/table_CT_CT.xvg cgff_production_calculations/smoothing/table/table_a0.xvg cgff_production_calculations/smoothing/table/table_b0.xvg cgff_production_calculations/smoothing/table/table_b1.xvg cgff_production_calculations/smoothing/table/table_b2.xvg cgff_production_calculations/smoothing/thermo_rerun/ cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/ cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/#md.log.1# cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/cgtoluene.gro cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/cgtoluene.mdp cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/cgtoluene.top cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/cgtoluene.tpr cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/index.ndx cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/md.log cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/mdout.mdp cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/qsub_xv.sh cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/rerun.edr cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/table_CB_CB.xvg cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/table_CB_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/table_CB_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/table_CF_CB.xvg cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/table_CF_CF.xvg cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/table_CF_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/table_CF_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/table_CM_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/table_CT_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/table_CT_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/table_a0.xvg cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/table_b0.xvg cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/table_b1.xvg cgff_production_calculations/smoothing/thermo_rerun/0_1_HT/table_b2.xvg cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/ cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/cgheptane.gro cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/cgheptane.mdp cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/cgheptane.top cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/cgheptane.tpr cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/index.ndx cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/md.log cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/mdout.mdp cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/qsub_xv.sh cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/table_CB_CB.xvg cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/table_CB_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/table_CB_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/table_CF_CB.xvg cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/table_CF_CF.xvg cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/table_CF_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/table_CF_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/table_CM_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/table_CT_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/table_CT_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/table_a0.xvg cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/table_b0.xvg cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/table_b1.xvg cgff_production_calculations/smoothing/thermo_rerun/1_0_HT/table_b2.xvg cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/ cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/heptol.gro cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/heptol.mdp cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/heptol.top cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/heptol.tpr cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/index.ndx cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/md.log cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/mdout.mdp cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/qsub_xv.sh cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/state.cpt cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/table_CB_CB.xvg cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/table_CB_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/table_CB_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/table_CF_CB.xvg cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/table_CF_CF.xvg cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/table_CF_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/table_CF_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/table_CM_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/table_CT_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/table_CT_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/table_a0.xvg cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/table_b0.xvg cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/table_b1.xvg cgff_production_calculations/smoothing/thermo_rerun/1_1_HT/table_b2.xvg cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/ cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/heptol.gro cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/heptol.mdp cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/heptol.top cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/heptol.tpr cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/index.ndx cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/md.log cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/mdout.mdp cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/qsub_xv.sh cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/table_CB_CB.xvg cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/table_CB_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/table_CB_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/table_CF_CB.xvg cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/table_CF_CF.xvg cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/table_CF_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/table_CF_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/table_CM_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/table_CT_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/table_CT_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/table_a0.xvg cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/table_b0.xvg cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/table_b1.xvg cgff_production_calculations/smoothing/thermo_rerun/1_4_HT/table_b2.xvg cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/ cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/heptol.gro cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/heptol.mdp cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/heptol.top cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/heptol.tpr cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/index.ndx cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/md.log cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/qsub_xv.sh cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/table_CB_CB.xvg cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/table_CB_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/table_CB_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/table_CF_CB.xvg cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/table_CF_CF.xvg cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/table_CF_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/table_CF_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/table_CM_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/table_CT_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/table_CT_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/table_a0.xvg cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/table_b0.xvg cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/table_b1.xvg cgff_production_calculations/smoothing/thermo_rerun/2_3_HT/table_b2.xvg cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/ cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/heptol.gro cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/heptol.mdp cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/heptol.top cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/heptol.tpr cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/index.ndx cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/md.log cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/mdout.mdp cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/qsub_xv.sh cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/table_CB_CB.xvg cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/table_CB_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/table_CB_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/table_CF_CB.xvg cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/table_CF_CF.xvg cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/table_CF_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/table_CF_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/table_CM_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/table_CT_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/table_CT_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/table_a0.xvg cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/table_b0.xvg cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/table_b1.xvg cgff_production_calculations/smoothing/thermo_rerun/3_2_HT/table_b2.xvg cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/ cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/heptol.gro cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/heptol.mdp cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/heptol.top cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/heptol.tpr cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/index.ndx cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/md.log cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/mdout.mdp cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/qsub_xv.sh cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/table_CB_CB.xvg cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/table_CB_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/table_CB_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/table_CF_CB.xvg cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/table_CF_CF.xvg cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/table_CF_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/table_CF_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/table_CM_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/table_CT_CM.xvg cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/table_CT_CT.xvg cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/table_a0.xvg cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/table_b0.xvg cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/table_b1.xvg cgff_production_calculations/smoothing/thermo_rerun/4_1_HT/table_b2.xvg cgff_production_calculations/smoothing/trimmed/ cgff_production_calculations/smoothing/trimmed/f_forces.Angle.total.Angle_CT-CM-CT.dat cgff_production_calculations/smoothing/trimmed/f_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/smoothing/trimmed/f_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/smoothing/trimmed/f_forces.BondStretch.total.Bond_CT-CM.dat cgff_production_calculations/smoothing/trimmed/f_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/smoothing/trimmed/f_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/smoothing/trimmed/f_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/smoothing/trimmed/f_forces.Pair_Interaction.total.CMCB.dat cgff_production_calculations/smoothing/trimmed/f_forces.Pair_Interaction.total.CMCF.dat cgff_production_calculations/smoothing/trimmed/f_forces.Pair_Interaction.total.CMCM.dat cgff_production_calculations/smoothing/trimmed/f_forces.Pair_Interaction.total.CTCB.dat cgff_production_calculations/smoothing/trimmed/f_forces.Pair_Interaction.total.CTCF.dat cgff_production_calculations/smoothing/trimmed/f_forces.Pair_Interaction.total.CTCM.dat cgff_production_calculations/smoothing/trimmed/f_forces.Pair_Interaction.total.CTCT.dat cgff_production_calculations/tol/ cgff_production_calculations/tol/#distance.xvg.1# cgff_production_calculations/tol/#distance.xvg.2# cgff_production_calculations/tol/#distance.xvg.3# cgff_production_calculations/tol/0_1_HepTol_CGFF.o4183176 cgff_production_calculations/tol/0_1_HepTol_CGFF.o4186670 cgff_production_calculations/tol/0_1_HepTol_CGMap.o4182896 cgff_production_calculations/tol/A_0_1_HepTol_CGFF.o4340350 cgff_production_calculations/tol/A_0_1_HepTol_CGFF.o4340402 cgff_production_calculations/tol/CGMap.sh cgff_production_calculations/tol/L.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/L.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/L.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/L.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/L.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/L_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/L_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/L_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/angle_CBCFCB.xvg cgff_production_calculations/tol/angle_CFCBCB.xvg cgff_production_calculations/tol/b_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/b_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/b_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/b_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/b_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/b_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/b_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/b_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/b_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/b_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/b_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/b_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/b_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/b_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/b_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/b_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/ cgff_production_calculations/tol/block_average/0_5000/ cgff_production_calculations/tol/block_average/0_5000/L.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/0_5000/L.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/0_5000/L.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/0_5000/L.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/0_5000/L.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/0_5000/L_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/0_5000/L_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/0_5000/L_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/0_5000/b_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/0_5000/b_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/0_5000/b_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/0_5000/b_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/0_5000/b_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/0_5000/b_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/0_5000/b_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/0_5000/b_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/0_5000/b_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/0_5000/b_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/0_5000/b_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/0_5000/b_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/0_5000/b_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/0_5000/b_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/0_5000/b_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/0_5000/b_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/0_5000/cgff.cgtoluene.642.0_5000.o6190065 cgff_production_calculations/tol/block_average/0_5000/cgtoluene.642.tpr cgff_production_calculations/tol/block_average/0_5000/cgtoluene.642.trr cgff_production_calculations/tol/block_average/0_5000/f_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/0_5000/f_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/0_5000/f_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/0_5000/f_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/0_5000/f_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/0_5000/f_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/0_5000/f_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/0_5000/f_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/0_5000/f_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/0_5000/f_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/0_5000/f_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/0_5000/f_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/0_5000/f_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/0_5000/f_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/0_5000/f_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/0_5000/f_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/0_5000/g.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/0_5000/g.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/0_5000/g.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/0_5000/g.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/0_5000/g.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/0_5000/g_cnt.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/0_5000/g_cnt.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/0_5000/g_cnt.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/0_5000/g_cnt.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/0_5000/g_cnt.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/0_5000/g_cnt_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/0_5000/g_cnt_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/0_5000/g_cnt_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/0_5000/g_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/0_5000/g_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/0_5000/g_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/0_5000/inp.txt cgff_production_calculations/tol/block_average/0_5000/log.txt cgff_production_calculations/tol/block_average/0_5000/out.total.txt cgff_production_calculations/tol/block_average/0_5000/par.txt cgff_production_calculations/tol/block_average/0_5000/qsub_xj.sh cgff_production_calculations/tol/block_average/0_5000/save.FF.dat cgff_production_calculations/tol/block_average/0_5000/save.L.dat cgff_production_calculations/tol/block_average/0_5000/save.M.dat cgff_production_calculations/tol/block_average/0_5000/save.M2.dat cgff_production_calculations/tol/block_average/0_5000/save.Nf.dat cgff_production_calculations/tol/block_average/0_5000/save.b_forces.dat cgff_production_calculations/tol/block_average/0_5000/save.b_struct.dat cgff_production_calculations/tol/block_average/0_5000/save.d2M.dat cgff_production_calculations/tol/block_average/0_5000/save.d2b.dat cgff_production_calculations/tol/block_average/0_5000/save.g.dat cgff_production_calculations/tol/block_average/0_5000/save.g_cnt.dat cgff_production_calculations/tol/block_average/0_5000/save.rescale.dat cgff_production_calculations/tol/block_average/0_5000/summarize_input.txt cgff_production_calculations/tol/block_average/0_5000/trjconv.0_5000.log cgff_production_calculations/tol/block_average/10000_15000/ cgff_production_calculations/tol/block_average/10000_15000/L.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/10000_15000/L.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/10000_15000/L.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/10000_15000/L.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/10000_15000/L.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/10000_15000/L_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/10000_15000/L_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/10000_15000/L_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/10000_15000/b_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/10000_15000/b_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/10000_15000/b_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/10000_15000/b_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/10000_15000/b_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/10000_15000/b_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/10000_15000/b_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/10000_15000/b_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/10000_15000/b_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/10000_15000/b_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/10000_15000/b_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/10000_15000/b_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/10000_15000/b_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/10000_15000/b_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/10000_15000/b_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/10000_15000/b_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/10000_15000/cgff.cgtoluene.642.10000_15000.o6190066 cgff_production_calculations/tol/block_average/10000_15000/cgff.cgtoluene.642.10000_15000.o6202373 cgff_production_calculations/tol/block_average/10000_15000/cgtoluene.642.tpr cgff_production_calculations/tol/block_average/10000_15000/cgtoluene.642.trr cgff_production_calculations/tol/block_average/10000_15000/f_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/10000_15000/f_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/10000_15000/f_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/10000_15000/f_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/10000_15000/f_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/10000_15000/f_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/10000_15000/f_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/10000_15000/f_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/10000_15000/f_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/10000_15000/f_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/10000_15000/f_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/10000_15000/f_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/10000_15000/f_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/10000_15000/f_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/10000_15000/f_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/10000_15000/f_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/10000_15000/g.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/10000_15000/g.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/10000_15000/g.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/10000_15000/g.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/10000_15000/g.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/10000_15000/g_cnt.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/10000_15000/g_cnt.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/10000_15000/g_cnt.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/10000_15000/g_cnt.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/10000_15000/g_cnt.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/10000_15000/g_cnt_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/10000_15000/g_cnt_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/10000_15000/g_cnt_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/10000_15000/g_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/10000_15000/g_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/10000_15000/g_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/10000_15000/inp.txt cgff_production_calculations/tol/block_average/10000_15000/log.txt cgff_production_calculations/tol/block_average/10000_15000/out.total.txt cgff_production_calculations/tol/block_average/10000_15000/par.txt cgff_production_calculations/tol/block_average/10000_15000/qsub_xj.sh cgff_production_calculations/tol/block_average/10000_15000/save.FF.dat cgff_production_calculations/tol/block_average/10000_15000/save.L.dat cgff_production_calculations/tol/block_average/10000_15000/save.M.dat cgff_production_calculations/tol/block_average/10000_15000/save.M2.dat cgff_production_calculations/tol/block_average/10000_15000/save.Nf.dat cgff_production_calculations/tol/block_average/10000_15000/save.b_forces.dat cgff_production_calculations/tol/block_average/10000_15000/save.b_struct.dat cgff_production_calculations/tol/block_average/10000_15000/save.d2M.dat cgff_production_calculations/tol/block_average/10000_15000/save.d2b.dat cgff_production_calculations/tol/block_average/10000_15000/save.g.dat cgff_production_calculations/tol/block_average/10000_15000/save.g_cnt.dat cgff_production_calculations/tol/block_average/10000_15000/save.rescale.dat cgff_production_calculations/tol/block_average/10000_15000/summarize_input.txt cgff_production_calculations/tol/block_average/10000_15000/trjconv.10000_15000.log cgff_production_calculations/tol/block_average/15000_20000/ cgff_production_calculations/tol/block_average/15000_20000/L.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/15000_20000/L.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/15000_20000/L.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/15000_20000/L.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/15000_20000/L.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/15000_20000/L_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/15000_20000/L_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/15000_20000/L_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/15000_20000/b_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/15000_20000/b_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/15000_20000/b_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/15000_20000/b_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/15000_20000/b_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/15000_20000/b_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/15000_20000/b_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/15000_20000/b_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/15000_20000/b_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/15000_20000/b_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/15000_20000/b_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/15000_20000/b_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/15000_20000/b_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/15000_20000/b_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/15000_20000/b_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/15000_20000/b_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/15000_20000/cgff.cgtoluene.642.15000_20000.o6190067 cgff_production_calculations/tol/block_average/15000_20000/cgff.cgtoluene.642.15000_20000.o6202370 cgff_production_calculations/tol/block_average/15000_20000/cgff.cgtoluene.642.15000_20000.o6202984 cgff_production_calculations/tol/block_average/15000_20000/cgtoluene.642.tpr cgff_production_calculations/tol/block_average/15000_20000/cgtoluene.642.trr cgff_production_calculations/tol/block_average/15000_20000/f_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/15000_20000/f_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/15000_20000/f_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/15000_20000/f_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/15000_20000/f_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/15000_20000/f_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/15000_20000/f_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/15000_20000/f_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/15000_20000/f_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/15000_20000/f_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/15000_20000/f_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/15000_20000/f_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/15000_20000/f_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/15000_20000/f_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/15000_20000/f_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/15000_20000/f_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/15000_20000/g.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/15000_20000/g.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/15000_20000/g.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/15000_20000/g.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/15000_20000/g.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/15000_20000/g_cnt.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/15000_20000/g_cnt.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/15000_20000/g_cnt.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/15000_20000/g_cnt.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/15000_20000/g_cnt.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/15000_20000/g_cnt_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/15000_20000/g_cnt_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/15000_20000/g_cnt_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/15000_20000/g_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/15000_20000/g_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/15000_20000/g_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/15000_20000/inp.txt cgff_production_calculations/tol/block_average/15000_20000/log.txt cgff_production_calculations/tol/block_average/15000_20000/out.total.txt cgff_production_calculations/tol/block_average/15000_20000/par.txt cgff_production_calculations/tol/block_average/15000_20000/qsub_xj.sh cgff_production_calculations/tol/block_average/15000_20000/save.FF.dat cgff_production_calculations/tol/block_average/15000_20000/save.L.dat cgff_production_calculations/tol/block_average/15000_20000/save.M.dat cgff_production_calculations/tol/block_average/15000_20000/save.M2.dat cgff_production_calculations/tol/block_average/15000_20000/save.Nf.dat cgff_production_calculations/tol/block_average/15000_20000/save.b_forces.dat cgff_production_calculations/tol/block_average/15000_20000/save.b_struct.dat cgff_production_calculations/tol/block_average/15000_20000/save.d2M.dat cgff_production_calculations/tol/block_average/15000_20000/save.d2b.dat cgff_production_calculations/tol/block_average/15000_20000/save.g.dat cgff_production_calculations/tol/block_average/15000_20000/save.g_cnt.dat cgff_production_calculations/tol/block_average/15000_20000/save.rescale.dat cgff_production_calculations/tol/block_average/15000_20000/summarize_input.txt cgff_production_calculations/tol/block_average/15000_20000/trjconv.15000_20000.log cgff_production_calculations/tol/block_average/20000_25000/ cgff_production_calculations/tol/block_average/20000_25000/L.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/20000_25000/L.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/20000_25000/L.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/20000_25000/L.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/20000_25000/L.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/20000_25000/L_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/20000_25000/L_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/20000_25000/L_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/20000_25000/b_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/20000_25000/b_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/20000_25000/b_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/20000_25000/b_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/20000_25000/b_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/20000_25000/b_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/20000_25000/b_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/20000_25000/b_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/20000_25000/b_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/20000_25000/b_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/20000_25000/b_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/20000_25000/b_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/20000_25000/b_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/20000_25000/b_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/20000_25000/b_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/20000_25000/b_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/20000_25000/cgff.cgtoluene.642.20000_25000.o6190068 cgff_production_calculations/tol/block_average/20000_25000/cgff.cgtoluene.642.20000_25000.o6202371 cgff_production_calculations/tol/block_average/20000_25000/cgtoluene.642.tpr cgff_production_calculations/tol/block_average/20000_25000/cgtoluene.642.trr cgff_production_calculations/tol/block_average/20000_25000/f_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/20000_25000/f_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/20000_25000/f_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/20000_25000/f_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/20000_25000/f_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/20000_25000/f_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/20000_25000/f_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/20000_25000/f_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/20000_25000/f_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/20000_25000/f_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/20000_25000/f_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/20000_25000/f_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/20000_25000/f_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/20000_25000/f_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/20000_25000/f_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/20000_25000/f_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/20000_25000/g.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/20000_25000/g.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/20000_25000/g.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/20000_25000/g.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/20000_25000/g.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/20000_25000/g_cnt.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/20000_25000/g_cnt.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/20000_25000/g_cnt.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/20000_25000/g_cnt.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/20000_25000/g_cnt.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/20000_25000/g_cnt_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/20000_25000/g_cnt_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/20000_25000/g_cnt_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/20000_25000/g_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/20000_25000/g_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/20000_25000/g_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/20000_25000/inp.txt cgff_production_calculations/tol/block_average/20000_25000/log.txt cgff_production_calculations/tol/block_average/20000_25000/out.total.txt cgff_production_calculations/tol/block_average/20000_25000/par.txt cgff_production_calculations/tol/block_average/20000_25000/qsub_xj.sh cgff_production_calculations/tol/block_average/20000_25000/save.FF.dat cgff_production_calculations/tol/block_average/20000_25000/save.L.dat cgff_production_calculations/tol/block_average/20000_25000/save.M.dat cgff_production_calculations/tol/block_average/20000_25000/save.M2.dat cgff_production_calculations/tol/block_average/20000_25000/save.Nf.dat cgff_production_calculations/tol/block_average/20000_25000/save.b_forces.dat cgff_production_calculations/tol/block_average/20000_25000/save.b_struct.dat cgff_production_calculations/tol/block_average/20000_25000/save.d2M.dat cgff_production_calculations/tol/block_average/20000_25000/save.d2b.dat cgff_production_calculations/tol/block_average/20000_25000/save.g.dat cgff_production_calculations/tol/block_average/20000_25000/save.g_cnt.dat cgff_production_calculations/tol/block_average/20000_25000/save.rescale.dat cgff_production_calculations/tol/block_average/20000_25000/summarize_input.txt cgff_production_calculations/tol/block_average/20000_25000/trjconv.20000_25000.log cgff_production_calculations/tol/block_average/25000_30000/ cgff_production_calculations/tol/block_average/25000_30000/L.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/25000_30000/L.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/25000_30000/L.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/25000_30000/L.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/25000_30000/L.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/25000_30000/L_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/25000_30000/L_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/25000_30000/L_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/25000_30000/b_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/25000_30000/b_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/25000_30000/b_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/25000_30000/b_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/25000_30000/b_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/25000_30000/b_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/25000_30000/b_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/25000_30000/b_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/25000_30000/b_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/25000_30000/b_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/25000_30000/b_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/25000_30000/b_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/25000_30000/b_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/25000_30000/b_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/25000_30000/b_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/25000_30000/b_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/25000_30000/cgff.cgtoluene.642.25000_30000.o6190069 cgff_production_calculations/tol/block_average/25000_30000/cgff.cgtoluene.642.25000_30000.o6202372 cgff_production_calculations/tol/block_average/25000_30000/cgtoluene.642.tpr cgff_production_calculations/tol/block_average/25000_30000/cgtoluene.642.trr cgff_production_calculations/tol/block_average/25000_30000/f_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/25000_30000/f_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/25000_30000/f_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/25000_30000/f_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/25000_30000/f_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/25000_30000/f_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/25000_30000/f_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/25000_30000/f_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/25000_30000/f_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/25000_30000/f_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/25000_30000/f_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/25000_30000/f_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/25000_30000/f_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/25000_30000/f_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/25000_30000/f_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/25000_30000/f_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/25000_30000/g.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/25000_30000/g.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/25000_30000/g.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/25000_30000/g.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/25000_30000/g.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/25000_30000/g_cnt.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/25000_30000/g_cnt.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/25000_30000/g_cnt.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/25000_30000/g_cnt.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/25000_30000/g_cnt.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/25000_30000/g_cnt_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/25000_30000/g_cnt_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/25000_30000/g_cnt_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/25000_30000/g_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/25000_30000/g_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/25000_30000/g_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/25000_30000/inp.txt cgff_production_calculations/tol/block_average/25000_30000/log.txt cgff_production_calculations/tol/block_average/25000_30000/out.total.txt cgff_production_calculations/tol/block_average/25000_30000/par.txt cgff_production_calculations/tol/block_average/25000_30000/qsub_xj.sh cgff_production_calculations/tol/block_average/25000_30000/save.FF.dat cgff_production_calculations/tol/block_average/25000_30000/save.L.dat cgff_production_calculations/tol/block_average/25000_30000/save.M.dat cgff_production_calculations/tol/block_average/25000_30000/save.M2.dat cgff_production_calculations/tol/block_average/25000_30000/save.Nf.dat cgff_production_calculations/tol/block_average/25000_30000/save.b_forces.dat cgff_production_calculations/tol/block_average/25000_30000/save.b_struct.dat cgff_production_calculations/tol/block_average/25000_30000/save.d2M.dat cgff_production_calculations/tol/block_average/25000_30000/save.d2b.dat cgff_production_calculations/tol/block_average/25000_30000/save.g.dat cgff_production_calculations/tol/block_average/25000_30000/save.g_cnt.dat cgff_production_calculations/tol/block_average/25000_30000/save.rescale.dat cgff_production_calculations/tol/block_average/25000_30000/summarize_input.txt cgff_production_calculations/tol/block_average/25000_30000/trjconv.25000_30000.log cgff_production_calculations/tol/block_average/30000_35000/ cgff_production_calculations/tol/block_average/30000_35000/L.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/30000_35000/L.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/30000_35000/L.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/30000_35000/L.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/30000_35000/L.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/30000_35000/L_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/30000_35000/L_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/30000_35000/L_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/30000_35000/b_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/30000_35000/b_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/30000_35000/b_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/30000_35000/b_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/30000_35000/b_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/30000_35000/b_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/30000_35000/b_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/30000_35000/b_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/30000_35000/b_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/30000_35000/b_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/30000_35000/b_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/30000_35000/b_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/30000_35000/b_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/30000_35000/b_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/30000_35000/b_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/30000_35000/b_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/30000_35000/cgff.cgtoluene.642.30000_35000.o6190070 cgff_production_calculations/tol/block_average/30000_35000/cgtoluene.642.tpr cgff_production_calculations/tol/block_average/30000_35000/cgtoluene.642.trr cgff_production_calculations/tol/block_average/30000_35000/f_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/30000_35000/f_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/30000_35000/f_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/30000_35000/f_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/30000_35000/f_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/30000_35000/f_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/30000_35000/f_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/30000_35000/f_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/30000_35000/f_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/30000_35000/f_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/30000_35000/f_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/30000_35000/f_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/30000_35000/f_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/30000_35000/f_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/30000_35000/f_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/30000_35000/f_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/30000_35000/g.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/30000_35000/g.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/30000_35000/g.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/30000_35000/g.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/30000_35000/g.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/30000_35000/g_cnt.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/30000_35000/g_cnt.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/30000_35000/g_cnt.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/30000_35000/g_cnt.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/30000_35000/g_cnt.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/30000_35000/g_cnt_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/30000_35000/g_cnt_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/30000_35000/g_cnt_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/30000_35000/g_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/30000_35000/g_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/30000_35000/g_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/30000_35000/inp.txt cgff_production_calculations/tol/block_average/30000_35000/log.txt cgff_production_calculations/tol/block_average/30000_35000/out.total.txt cgff_production_calculations/tol/block_average/30000_35000/par.txt cgff_production_calculations/tol/block_average/30000_35000/qsub_xj.sh cgff_production_calculations/tol/block_average/30000_35000/save.FF.dat cgff_production_calculations/tol/block_average/30000_35000/save.L.dat cgff_production_calculations/tol/block_average/30000_35000/save.M.dat cgff_production_calculations/tol/block_average/30000_35000/save.M2.dat cgff_production_calculations/tol/block_average/30000_35000/save.Nf.dat cgff_production_calculations/tol/block_average/30000_35000/save.b_forces.dat cgff_production_calculations/tol/block_average/30000_35000/save.b_struct.dat cgff_production_calculations/tol/block_average/30000_35000/save.d2M.dat cgff_production_calculations/tol/block_average/30000_35000/save.d2b.dat cgff_production_calculations/tol/block_average/30000_35000/save.g.dat cgff_production_calculations/tol/block_average/30000_35000/save.g_cnt.dat cgff_production_calculations/tol/block_average/30000_35000/save.rescale.dat cgff_production_calculations/tol/block_average/30000_35000/summarize_input.txt cgff_production_calculations/tol/block_average/30000_35000/trjconv.30000_35000.log cgff_production_calculations/tol/block_average/35000_40000/ cgff_production_calculations/tol/block_average/35000_40000/L.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/35000_40000/L.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/35000_40000/L.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/35000_40000/L.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/35000_40000/L.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/35000_40000/L_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/35000_40000/L_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/35000_40000/L_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/35000_40000/b_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/35000_40000/b_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/35000_40000/b_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/35000_40000/b_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/35000_40000/b_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/35000_40000/b_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/35000_40000/b_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/35000_40000/b_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/35000_40000/b_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/35000_40000/b_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/35000_40000/b_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/35000_40000/b_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/35000_40000/b_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/35000_40000/b_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/35000_40000/b_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/35000_40000/b_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/35000_40000/cgff.cgtoluene.642.35000_40000.o6190071 cgff_production_calculations/tol/block_average/35000_40000/cgtoluene.642.tpr cgff_production_calculations/tol/block_average/35000_40000/cgtoluene.642.trr cgff_production_calculations/tol/block_average/35000_40000/f_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/35000_40000/f_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/35000_40000/f_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/35000_40000/f_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/35000_40000/f_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/35000_40000/f_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/35000_40000/f_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/35000_40000/f_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/35000_40000/f_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/35000_40000/f_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/35000_40000/f_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/35000_40000/f_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/35000_40000/f_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/35000_40000/f_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/35000_40000/f_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/35000_40000/f_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/35000_40000/g.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/35000_40000/g.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/35000_40000/g.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/35000_40000/g.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/35000_40000/g.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/35000_40000/g_cnt.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/35000_40000/g_cnt.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/35000_40000/g_cnt.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/35000_40000/g_cnt.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/35000_40000/g_cnt.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/35000_40000/g_cnt_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/35000_40000/g_cnt_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/35000_40000/g_cnt_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/35000_40000/g_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/35000_40000/g_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/35000_40000/g_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/35000_40000/inp.txt cgff_production_calculations/tol/block_average/35000_40000/log.txt cgff_production_calculations/tol/block_average/35000_40000/out.total.txt cgff_production_calculations/tol/block_average/35000_40000/par.txt cgff_production_calculations/tol/block_average/35000_40000/qsub_xj.sh cgff_production_calculations/tol/block_average/35000_40000/save.FF.dat cgff_production_calculations/tol/block_average/35000_40000/save.L.dat cgff_production_calculations/tol/block_average/35000_40000/save.M.dat cgff_production_calculations/tol/block_average/35000_40000/save.M2.dat cgff_production_calculations/tol/block_average/35000_40000/save.Nf.dat cgff_production_calculations/tol/block_average/35000_40000/save.b_forces.dat cgff_production_calculations/tol/block_average/35000_40000/save.b_struct.dat cgff_production_calculations/tol/block_average/35000_40000/save.d2M.dat cgff_production_calculations/tol/block_average/35000_40000/save.d2b.dat cgff_production_calculations/tol/block_average/35000_40000/save.g.dat cgff_production_calculations/tol/block_average/35000_40000/save.g_cnt.dat cgff_production_calculations/tol/block_average/35000_40000/save.rescale.dat cgff_production_calculations/tol/block_average/35000_40000/summarize_input.txt cgff_production_calculations/tol/block_average/35000_40000/trjconv.35000_40000.log cgff_production_calculations/tol/block_average/40000_45000/ cgff_production_calculations/tol/block_average/40000_45000/L.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/40000_45000/L.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/40000_45000/L.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/40000_45000/L.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/40000_45000/L.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/40000_45000/L_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/40000_45000/L_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/40000_45000/L_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/40000_45000/b_forces.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/40000_45000/b_forces.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/40000_45000/b_forces.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/40000_45000/b_forces.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/40000_45000/b_forces.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/40000_45000/b_forces_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/40000_45000/b_forces_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/40000_45000/b_forces_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/40000_45000/b_struct.BondStretch.total.Bond_CB-CB.dat cgff_production_calculations/tol/block_average/40000_45000/b_struct.BondStretch.total.Bond_CF-CB.dat cgff_production_calculations/tol/block_average/40000_45000/b_struct.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/40000_45000/b_struct.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/40000_45000/b_struct.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/40000_45000/b_struct_coeff.Pair_Interaction.total.CBCB.dat cgff_production_calculations/tol/block_average/40000_45000/b_struct_coeff.Pair_Interaction.total.CFCB.dat cgff_production_calculations/tol/block_average/40000_45000/b_struct_coeff.Pair_Interaction.total.CFCF.dat cgff_production_calculations/tol/block_average/40000_45000/cgff.cgtoluene.642.40000_45000.o6190072 cgff_production_calculations/tol/block_average/40000_45000/cgtoluene.642.tpr