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ethane/CGFF/1-site/NPT/175K/b_forces_coeff.Pair_Interaction.total.CACA.dat 16461 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/b_struct.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/b_struct_coeff.Pair_Interaction.total.CACA.dat 30520 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/cgff-ETH_1.NPT.175.o2435319 16461 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/f_forces.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/f_forces_coeff.Pair_Interaction.total.CACA.dat 16461 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/f_struct.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/f_struct_coeff.Pair_Interaction.total.CACA.dat 16461 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/g.Pair_Interaction.total.CACA.dat 16461 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/g_cnt.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/g_cnt_coeff.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/g_coeff.Pair_Interaction.total.CACA.dat 153 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/inp.txt 7701 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/log.txt 917 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/out.total.txt 680 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/par.txt 249 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/qsub.sh 22 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/save.FF.dat 1349 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/save.L.dat 49613 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/save.M.dat 48564 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/save.M2.dat 7 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/save.Nf.dat 1374 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/save.b_forces.dat 1382 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/save.b_struct.dat 48564 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/save.d2M.dat 1503 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/save.d2b.dat 1417 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/save.g.dat 1518 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/save.g_cnt.dat 1518 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/save.rescale.dat 2411 08-01-2018 10:14 ethane/CGFF/1-site/NPT/175K/summarize_input.txt 0 08-01-2018 10:14 ethane/CGFF/1-site/NVT/ 0 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/ 16151 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/L.Pair_Interaction.total.CACA.dat 1643 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/L_coeff.Pair_Interaction.total.CACA.dat 16151 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/b_forces.Pair_Interaction.total.CACA.dat 1643 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/b_forces_coeff.Pair_Interaction.total.CACA.dat 16151 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/b_struct.Pair_Interaction.total.CACA.dat 1643 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/b_struct_coeff.Pair_Interaction.total.CACA.dat 30480 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/cgff-ETH_1.NVT.100.o2435320 16151 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/f_forces.Pair_Interaction.total.CACA.dat 1643 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/f_forces_coeff.Pair_Interaction.total.CACA.dat 16151 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/f_struct.Pair_Interaction.total.CACA.dat 1643 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/f_struct_coeff.Pair_Interaction.total.CACA.dat 16151 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/g.Pair_Interaction.total.CACA.dat 16151 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/g_cnt.Pair_Interaction.total.CACA.dat 1643 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/g_cnt_coeff.Pair_Interaction.total.CACA.dat 1643 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/g_coeff.Pair_Interaction.total.CACA.dat 153 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/inp.txt 7679 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/log.txt 917 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/out.total.txt 680 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/par.txt 249 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/qsub.sh 22 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/save.FF.dat 1349 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/save.L.dat 49572 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/save.M.dat 48564 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/save.M2.dat 7 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/save.Nf.dat 1376 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/save.b_forces.dat 1374 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/save.b_struct.dat 48564 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/save.d2M.dat 1491 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/save.d2b.dat 1416 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/save.g.dat 1520 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/save.g_cnt.dat 1520 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/save.rescale.dat 2411 08-01-2018 10:14 ethane/CGFF/1-site/NVT/100K/summarize_input.txt 0 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/ 16151 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/L.Pair_Interaction.total.CACA.dat 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ethane/CGFF/1-site/NVT/125K/g.Pair_Interaction.total.CACA.dat 16151 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/g_cnt.Pair_Interaction.total.CACA.dat 1643 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/g_cnt_coeff.Pair_Interaction.total.CACA.dat 1643 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/g_coeff.Pair_Interaction.total.CACA.dat 153 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/inp.txt 7679 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/log.txt 917 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/out.total.txt 680 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/par.txt 249 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/qsub.sh 22 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/save.FF.dat 1349 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/save.L.dat 49572 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/save.M.dat 48564 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/save.M2.dat 7 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/save.Nf.dat 1376 08-01-2018 10:14 ethane/CGFF/1-site/NVT/125K/save.b_forces.dat 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ethane/CGFF/1-site/NVT/150K/b_struct_coeff.Pair_Interaction.total.CACA.dat 30480 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/cgff-ETH_1.NVT.150.o2435323 35266 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/f_forces.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/f_forces_coeff.Pair_Interaction.total.CACA.dat 16461 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/f_struct.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/f_struct_coeff.Pair_Interaction.total.CACA.dat 16461 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/g.Pair_Interaction.total.CACA.dat 16461 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/g_cnt.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/g_cnt_coeff.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/g_coeff.Pair_Interaction.total.CACA.dat 153 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/inp.txt 7701 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/log.txt 918 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/out.total.txt 680 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/par.txt 249 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/qsub.sh 23 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/save.FF.dat 1349 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/save.L.dat 49575 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/save.M.dat 48564 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/save.M2.dat 7 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/save.Nf.dat 1376 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/save.b_forces.dat 1385 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/save.b_struct.dat 48564 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/save.d2M.dat 1504 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/save.d2b.dat 1417 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/save.g.dat 1520 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/save.g_cnt.dat 1520 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/save.rescale.dat 2411 08-01-2018 10:14 ethane/CGFF/1-site/NVT/150K/summarize_input.txt 0 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/ 16461 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/L.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/L_coeff.Pair_Interaction.total.CACA.dat 16461 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/b_forces.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/b_forces_coeff.Pair_Interaction.total.CACA.dat 16461 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/b_struct.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/b_struct_coeff.Pair_Interaction.total.CACA.dat 30480 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/cgff-ETH_1.NVT.175.o2435324 16461 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/f_forces.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/f_forces_coeff.Pair_Interaction.total.CACA.dat 16461 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/f_struct.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/f_struct_coeff.Pair_Interaction.total.CACA.dat 16461 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/g.Pair_Interaction.total.CACA.dat 16461 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/g_cnt.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/g_cnt_coeff.Pair_Interaction.total.CACA.dat 1674 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/g_coeff.Pair_Interaction.total.CACA.dat 153 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/inp.txt 7701 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/log.txt 919 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/out.total.txt 680 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/par.txt 249 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/qsub.sh 23 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/save.FF.dat 1349 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/save.L.dat 49602 08-01-2018 10:14 ethane/CGFF/1-site/NVT/175K/save.M.dat 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ethane/CGFF/2-site/NVT/100K/summarize_input.txt 0 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/ 682 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/L.BondStretch.total.Bond_CT-CT.dat 16771 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/L.Pair_Interaction.total.CTCT.dat 1705 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/L_coeff.Pair_Interaction.total.CTCT.dat 682 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/b_forces.BondStretch.total.Bond_CT-CT.dat 16771 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/b_forces.Pair_Interaction.total.CTCT.dat 1705 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/b_forces_coeff.Pair_Interaction.total.CTCT.dat 682 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/b_struct.BondStretch.total.Bond_CT-CT.dat 16771 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/b_struct.Pair_Interaction.total.CTCT.dat 1705 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/b_struct_coeff.Pair_Interaction.total.CTCT.dat 30480 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/cgff-ETH_2.NVT.125.o2438943 682 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08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/g_coeff.Pair_Interaction.total.CTCT.dat 153 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/inp.txt 41490 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/log.txt 1503 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/out.total.txt 917 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/par.txt 249 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/qsub.sh 24 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/save.FF.dat 8968 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/save.L.dat 2122757 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/save.M.dat 2120932 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/save.M2.dat 7 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/save.Nf.dat 9014 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/save.b_forces.dat 9413 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/save.b_struct.dat 2120932 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/save.d2M.dat 9255 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/save.d2b.dat 9079 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/save.g.dat 9202 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/save.g_cnt.dat 9202 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/save.rescale.dat 2864 08-01-2018 10:14 ethane/CGFF/2-site/NVT/125K/summarize_input.txt 0 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/ 744 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/L.BondStretch.total.Bond_CT-CT.dat 16771 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/L.Pair_Interaction.total.CTCT.dat 1705 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/L_coeff.Pair_Interaction.total.CTCT.dat 744 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/b_forces.BondStretch.total.Bond_CT-CT.dat 16771 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/b_forces.Pair_Interaction.total.CTCT.dat 1705 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/b_forces_coeff.Pair_Interaction.total.CTCT.dat 744 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/b_struct.BondStretch.total.Bond_CT-CT.dat 16771 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/b_struct.Pair_Interaction.total.CTCT.dat 1705 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/b_struct_coeff.Pair_Interaction.total.CTCT.dat 30480 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/cgff-ETH_2.NVT.150.o2438944 744 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/f_forces.BondStretch.total.Bond_CT-CT.dat 16771 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/f_forces.Pair_Interaction.total.CTCT.dat 1705 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/f_forces_coeff.Pair_Interaction.total.CTCT.dat 744 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/f_struct.BondStretch.total.Bond_CT-CT.dat 16771 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/f_struct.Pair_Interaction.total.CTCT.dat 1705 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/f_struct_coeff.Pair_Interaction.total.CTCT.dat 744 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/g.BondStretch.total.Bond_CT-CT.dat 16771 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/g.Pair_Interaction.total.CTCT.dat 744 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/g_cnt.BondStretch.total.Bond_CT-CT.dat 16771 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/g_cnt.Pair_Interaction.total.CTCT.dat 1705 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/g_cnt_coeff.Pair_Interaction.total.CTCT.dat 1705 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/g_coeff.Pair_Interaction.total.CTCT.dat 153 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/inp.txt 41534 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/log.txt 1504 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/out.total.txt 917 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/par.txt 249 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/qsub.sh 24 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/save.FF.dat 8968 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/save.L.dat 2122816 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/save.M.dat 2120932 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/save.M2.dat 7 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/save.Nf.dat 9016 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/save.b_forces.dat 9416 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/save.b_struct.dat 2120932 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/save.d2M.dat 9266 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/save.d2b.dat 9080 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/save.g.dat 9204 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/save.g_cnt.dat 9204 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/save.rescale.dat 2864 08-01-2018 10:14 ethane/CGFF/2-site/NVT/150K/summarize_input.txt 0 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/ 806 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/L.BondStretch.total.Bond_CT-CT.dat 16771 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/L.Pair_Interaction.total.CTCT.dat 1705 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/L_coeff.Pair_Interaction.total.CTCT.dat 806 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/b_forces.BondStretch.total.Bond_CT-CT.dat 16771 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/b_forces.Pair_Interaction.total.CTCT.dat 1705 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/b_forces_coeff.Pair_Interaction.total.CTCT.dat 806 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/b_struct.BondStretch.total.Bond_CT-CT.dat 16771 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/b_struct.Pair_Interaction.total.CTCT.dat 1705 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/b_struct_coeff.Pair_Interaction.total.CTCT.dat 30480 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/cgff-ETH_2.NVT.175.o2438945 806 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/f_forces.BondStretch.total.Bond_CT-CT.dat 16771 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/f_forces.Pair_Interaction.total.CTCT.dat 1705 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/f_forces_coeff.Pair_Interaction.total.CTCT.dat 806 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/f_struct.BondStretch.total.Bond_CT-CT.dat 16771 08-01-2018 10:14 ethane/CGFF/2-site/NVT/175K/f_struct.Pair_Interaction.total.CTCT.dat 1705 08-01-2018 10:14 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08-01-2018 10:14 ethane/CGFF/export.dat 153 08-01-2018 10:14 ethane/CGFF/inp.txt 1421 08-01-2018 10:14 ethane/CGFF/par.txt 680 08-01-2018 10:14 ethane/CGFF/par_1site.txt 917 08-01-2018 10:14 ethane/CGFF/par_2site.txt 269 08-01-2018 10:14 ethane/CGFF/qsub.sh 23900 08-01-2018 10:14 ethane/CGFF/raw_G.dat 0 08-01-2018 10:14 ethane/CG_rdfs/ 21703 08-01-2018 10:14 ethane/CG_rdfs/1.NPT.100.CA-CA.xvg 21810 08-01-2018 10:14 ethane/CG_rdfs/1.NPT.110.CA-CA.xvg 22106 08-01-2018 10:14 ethane/CG_rdfs/1.NPT.125.CA-CA.xvg 22451 08-01-2018 10:14 ethane/CG_rdfs/1.NPT.150.CA-CA.xvg 22759 08-01-2018 10:14 ethane/CG_rdfs/1.NPT.165.CA-CA.xvg 22885 08-01-2018 10:14 ethane/CG_rdfs/1.NPT.175.CA-CA.xvg 22187 08-01-2018 10:14 ethane/CG_rdfs/1.NVT.100.CA-CA.xvg 22185 08-01-2018 10:14 ethane/CG_rdfs/1.NVT.125.CA-CA.xvg 22173 08-01-2018 10:14 ethane/CG_rdfs/1.NVT.150.CA-CA.xvg 22175 08-01-2018 10:14 ethane/CG_rdfs/1.NVT.175.CA-CA.xvg 0 08-01-2018 10:12 ethane/CG_trajectories/ 0 08-01-2018 10:12 ethane/CG_trajectories/100K/ 10319 08-01-2018 10:12 ethane/CG_trajectories/100K/#mdout-cg_ethane.mdp.1# 8054 08-01-2018 10:12 ethane/CG_trajectories/100K/#mdrun-cg_ethane.log.1# 8141 08-01-2018 10:12 ethane/CG_trajectories/100K/#mdrun-cg_ethane.log.2# 0 08-01-2018 10:12 ethane/CG_trajectories/100K/ETH_100.o6460422 0 08-01-2018 10:12 ethane/CG_trajectories/100K/ETH_100.o6460688 54761 08-01-2018 10:12 ethane/CG_trajectories/100K/cg_ethane.confout.gro 8441072 08-01-2018 10:12 ethane/CG_trajectories/100K/cg_ethane.edr 54796 08-01-2018 10:12 ethane/CG_trajectories/100K/cg_ethane.gro 2172 08-01-2018 10:12 ethane/CG_trajectories/100K/cg_ethane.mdp 631 08-01-2018 10:12 ethane/CG_trajectories/100K/cg_ethane.top 40224 08-01-2018 10:12 ethane/CG_trajectories/100K/cg_ethane.tpr 572657260 08-01-2018 10:12 ethane/CG_trajectories/100K/cg_ethane.trr 3380 08-01-2018 10:12 ethane/CG_trajectories/100K/grompp-cg_ethane.log 14463 08-01-2018 10:12 ethane/CG_trajectories/100K/index.ndx 10319 08-01-2018 10:12 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ethane/pmatch/additional_statepoints/ethane_165/iter1/qsub.sh 108959 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter1/state1.restart 108959 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter1/state2.restart 765527 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter1/temp.dat 2277940008 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter1/trajdump.txt 795589 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter1/vdw_E.dat 765558 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter1/vol.dat 90578 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter1/vol_dist_comp.png 10849 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter1/vol_dist_comp.xvg 0 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/ 18 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/AA_g_cnt.dat 0 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/CG_Q.dat 18 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/CG_g_cnt.dat 0 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/ETH_pmatch_165.o6298305 42 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/Q.dat 255050 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/aa_pressures.xvg 202637 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/aa_pv.dat 3197 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/aa_pv_curve.dat 399 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/aa_vol_dist.xvg 250786 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/aa_volumes.xvg 318930 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/angle_E.dat 4646 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/block_error_aa_pv_curve.dat 2494 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/block_error_cg_pv_curve.dat 318930 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/bond_E.dat 780998 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/cg_pressures.dat 608807 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/cg_pv.dat 1738 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/cg_pv_curve.dat 399 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/cg_vol_dist.xvg 765558 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/cg_volumes.dat 37699 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/cgethane.data 3021 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/cgethane.lmp 77355 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/comp_pv_eos.png 14111 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/comp_pv_eos.xvg 639 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/config.ini 318930 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/coul_E.dat 795526 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/enthalpy.dat 4718 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/error_aa_pv_curve.dat 2498 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/error_cg_pv_curve.dat 588 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/error_cg_vol_dist.xvg 18 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/g_cnt.dat 765638 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/kinetic_E.dat 116470 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/lammps_nb_CA-CA.table 2255185 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/log.lammps 158 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/log.txt 0 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/out.dat 795524 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/potential_E.dat 781078 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/press.dat 3345920 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/press_tens.dat 74 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/psi.dat 359 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/qsub.sh 2016 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/sample_aa_pv_curve.dat 1125 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/sample_cg_pv_curve.dat 108959 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/state1.restart 108959 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/state2.restart 765450 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/temp.dat --------- ------- 10048934219 248 files ===================================================== Content of ZIP archive ethane-20.zip ===================================================== Archive: ethane-20.zip Length Date Time Name --------- ---------- ----- ---- 2277735759 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/trajdump.txt 795524 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/vdw_E.dat 765513 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/vol.dat 86958 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/vol_dist_comp.png 10839 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/iter2/vol_dist_comp.xvg 0 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/setup/ 255050 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/setup/aa_pressures.xvg 250786 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/setup/aa_volumes.xvg 54796 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/setup/cg_ethane.gro 619 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/setup/cg_ethane.top 37699 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/setup/cgethane.data 3021 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/setup/cgethane.lmp 16839 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/setup/index.ndx 116470 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/setup/lammps_nb_CA-CA.table 359 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/setup/qsub.sh 291761 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/setup/table_CA_CA.xvg 1345 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/setup/translate_table.py 8255 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/setup/translate_top.py 7177 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/setup/translate_top_fn.py 8959 08-01-2018 10:09 ethane/pmatch/additional_statepoints/ethane_165/setup/translate_top_fn.pyc 46117 08-01-2018 10:09 ethane/pmatch/all_pv_eos.agr 7981 08-01-2018 10:09 ethane/pmatch/block_error_aa_pv_eos_100.dat 3330 08-01-2018 10:10 ethane/pmatch/block_error_aa_pv_eos_125.dat 6671 08-01-2018 10:09 ethane/pmatch/block_error_aa_pv_eos_150.dat 16817 08-01-2018 10:09 ethane/pmatch/block_error_aa_pv_eos_175.dat 2690 08-01-2018 10:10 ethane/pmatch/block_error_cg_pv_eos_100.dat 3461 08-01-2018 10:09 ethane/pmatch/block_error_cg_pv_eos_125.dat 4971 08-01-2018 10:09 ethane/pmatch/block_error_cg_pv_eos_150.dat 6660 08-01-2018 10:09 ethane/pmatch/block_error_cg_pv_eos_175.dat 2183 08-01-2018 10:10 ethane/pmatch/cg_ethane.mdp 40224 08-01-2018 10:09 ethane/pmatch/cg_ethane.tpr 1880 08-01-2018 10:09 ethane/pmatch/cg_pv_eos_100.dat 2417 08-01-2018 10:09 ethane/pmatch/cg_pv_eos_125.dat 3459 08-01-2018 10:10 ethane/pmatch/cg_pv_eos_150.dat 4635 08-01-2018 10:09 ethane/pmatch/cg_pv_eos_175.dat 8073 08-01-2018 10:09 ethane/pmatch/error_aa_pv_eos_100.dat 3439 08-01-2018 10:10 ethane/pmatch/error_aa_pv_eos_125.dat 6821 08-01-2018 10:09 ethane/pmatch/error_aa_pv_eos_150.dat 17023 08-01-2018 10:10 ethane/pmatch/error_aa_pv_eos_175.dat 2693 08-01-2018 10:10 ethane/pmatch/error_cg_pv_eos_100.dat 3467 08-01-2018 10:09 ethane/pmatch/error_cg_pv_eos_125.dat 4980 08-01-2018 10:09 ethane/pmatch/error_cg_pv_eos_150.dat 6678 08-01-2018 10:10 ethane/pmatch/error_cg_pv_eos_175.dat 1775 08-01-2018 10:10 ethane/pmatch/gen_CG_RDFs.sh 0 08-01-2018 10:10 ethane/pmatch/gen_input/ 0 08-01-2018 10:10 ethane/pmatch/gen_input/1-site/ 0 08-01-2018 10:10 ethane/pmatch/gen_input/1-site/100K/ 37657 08-01-2018 10:10 ethane/pmatch/gen_input/1-site/100K/cgethane.data 3320 08-01-2018 10:10 ethane/pmatch/gen_input/1-site/100K/cgethane.lmp 116424 08-01-2018 10:10 ethane/pmatch/gen_input/1-site/100K/lammps_nb_CA-CA.table 0 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ethane/pmatch/gen_input/2-site/100K/ 88024 08-01-2018 10:10 ethane/pmatch/gen_input/2-site/100K/cgethane.data 3321 08-01-2018 10:10 ethane/pmatch/gen_input/2-site/100K/cgethane.lmp 51189 08-01-2018 10:10 ethane/pmatch/gen_input/2-site/100K/lammps_bond_CT-CT.table 116550 08-01-2018 10:10 ethane/pmatch/gen_input/2-site/100K/lammps_nb_CT-CT.table 0 08-01-2018 10:10 ethane/pmatch/gen_input/2-site/125K/ 88074 08-01-2018 10:10 ethane/pmatch/gen_input/2-site/125K/cgethane.data 3321 08-01-2018 10:10 ethane/pmatch/gen_input/2-site/125K/cgethane.lmp 51630 08-01-2018 10:10 ethane/pmatch/gen_input/2-site/125K/lammps_bond_CT-CT.table 116589 08-01-2018 10:10 ethane/pmatch/gen_input/2-site/125K/lammps_nb_CT-CT.table 0 08-01-2018 10:10 ethane/pmatch/gen_input/2-site/150K/ 88074 08-01-2018 10:10 ethane/pmatch/gen_input/2-site/150K/cgethane.data 3321 08-01-2018 10:10 ethane/pmatch/gen_input/2-site/150K/cgethane.lmp 51426 08-01-2018 10:10 ethane/pmatch/gen_input/2-site/150K/lammps_bond_CT-CT.table 116660 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08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/aa_vol_dist.xvg 250487 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/aa_volumes.xvg 318930 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/angle_E.dat 318930 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/bond_E.dat 260492 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/cg_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/cg_vol_dist.xvg 250497 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/cg_volumes.xvg 37674 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/cgethane.data 3293 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/cgethane.lmp 617 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/config.ini 318930 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/coul_E.dat 915660 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/enthalpy.dat 588 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/error_aa_vol_dist.xvg 588 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/error_cg_vol_dist.xvg 18 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/g_cnt.dat 915614 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/kinetic_E.dat 116462 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/lammps_nb_CA-CA.table 2254321 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/log.lammps 2251917 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/out.dat 118443700 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/outfile.xtc 915574 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/potential_E.dat 930918 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/press.dat 4246441 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/press_tens.dat 75 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/psi.dat 305 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/qsub.sh 108670 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/state1.restart 108670 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/state2.restart 915594 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/temp.dat 915574 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/vdw_E.dat 915572 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/vol.dat 76449 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/vol_dist_comp.png 10897 08-01-2018 10:09 ethane/pmatch/iter0/1-site/125K/vol_dist_comp.xvg 0 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/ 0 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/ETH_pmatch_150.1.o3124858 52 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/Q.dat 254728 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/aa_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/aa_vol_dist.xvg 250481 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/aa_volumes.xvg 318930 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/angle_E.dat 318930 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/bond_E.dat 260477 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/cg_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/cg_vol_dist.xvg 250482 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/cg_volumes.xvg 37681 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/cgethane.data 3293 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/cgethane.lmp 617 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/config.ini 318930 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/coul_E.dat 941587 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/enthalpy.dat 588 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/error_aa_vol_dist.xvg 588 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/error_cg_vol_dist.xvg 18 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/g_cnt.dat 915537 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/kinetic_E.dat 116568 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/lammps_nb_CA-CA.table 2254319 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/log.lammps 79 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/log.txt 2251915 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/out.dat 118570308 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/outfile.xtc 945714 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/potential_E.dat 930992 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/press.dat 4246314 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/press_tens.dat 75 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/psi.dat 305 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/qsub.sh 108670 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/state1.restart 108670 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/state2.restart 915596 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/temp.dat 945714 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/vdw_E.dat 915552 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/vol.dat 75861 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/vol_dist_comp.png 10868 08-01-2018 10:09 ethane/pmatch/iter0/1-site/150K/vol_dist_comp.xvg 0 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/ 0 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/ETH_pmatch_175.1.o3124864 52 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/Q.dat 254749 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/aa_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/aa_vol_dist.xvg 250488 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/aa_volumes.xvg 318930 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/angle_E.dat 318930 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/bond_E.dat 260493 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/cg_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/cg_vol_dist.xvg 250488 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/cg_volumes.xvg 37688 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/cgethane.data 3294 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/cgethane.lmp 617 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/config.ini 318930 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/coul_E.dat 945626 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/enthalpy.dat 588 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/error_aa_vol_dist.xvg 588 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/error_cg_vol_dist.xvg 18 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/g_cnt.dat 915624 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/kinetic_E.dat 116628 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/lammps_nb_CA-CA.table 2254321 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/log.lammps 79 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/log.txt 2251916 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/out.dat 118903116 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/outfile.xtc 945589 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/potential_E.dat 930944 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/press.dat 4246387 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/press_tens.dat 76 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/psi.dat 305 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/qsub.sh 108670 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/state1.restart 108670 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/state2.restart 915525 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/temp.dat 945589 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/vdw_E.dat 915563 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/vol.dat 82234 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/vol_dist_comp.png 10830 08-01-2018 10:09 ethane/pmatch/iter0/1-site/175K/vol_dist_comp.xvg 0 08-01-2018 10:09 ethane/pmatch/iter0/2-site/ 0 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/ 244 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/ETH_pmatch_100.2.o2285809 0 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/ETH_pmatch_100.2.o2285816 50 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/Q.dat 254611 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/aa_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/aa_vol_dist.xvg 250472 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/aa_volumes.xvg 290561 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/angle_E.dat 835921 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/bond_E.dat 260383 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/cg_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/cg_vol_dist.xvg 250480 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/cg_volumes.xvg 88024 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/cgethane.data 3306 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/cgethane.lmp 618 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/config.ini 290561 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/coul_E.dat 863445 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/enthalpy.dat 588 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/error_aa_vol_dist.xvg 588 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/error_cg_vol_dist.xvg 18 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/g_cnt.dat 835902 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/kinetic_E.dat 51189 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/lammps_bond_CT-CT.table 116550 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/lammps_nb_CT-CT.table 2060367 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/log.lammps 79 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/log.txt 2057624 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/out.dat 180841976 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/outfile.xtc 863484 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/potential_E.dat 849753 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/press.dat 3878540 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/press_tens.dat 74 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/psi.dat 75 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/psi_old.dat 285 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/qsub.sh 229228 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/state1.restart 229228 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/state2.restart 835836 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/temp.dat 863423 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/vdw_E.dat 835947 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/vol.dat 83271 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/vol_dist_comp.png 10831 08-01-2018 10:09 ethane/pmatch/iter0/2-site/100K/vol_dist_comp.xvg 0 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/ 0 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/ETH_pmatch_125.2.o2285925 50 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/Q.dat 254728 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/aa_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/aa_vol_dist.xvg 250487 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/aa_volumes.xvg 277460 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/angle_E.dat 799198 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/bond_E.dat 251381 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/cg_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/cg_vol_dist.xvg 250480 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/cg_volumes.xvg 88074 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/cgethane.data 3309 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/cgethane.lmp 618 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/config.ini 277460 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/coul_E.dat 825378 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/enthalpy.dat 588 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/error_aa_vol_dist.xvg 588 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/error_cg_vol_dist.xvg 18 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/g_cnt.dat 799235 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/kinetic_E.dat 51630 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/lammps_bond_CT-CT.table 116589 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/lammps_nb_CT-CT.table 1971046 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/log.lammps 79 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/log.txt 1968298 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/out.dat 172878816 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/outfile.xtc 825413 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/potential_E.dat 812411 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/press.dat 3709543 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/press_tens.dat 76 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/psi.dat 74 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/psi_old.dat 285 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/qsub.sh 3533 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/restart-part2.lmp 3533 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/restart-part3.lmp 3463 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/restart.lmp 229228 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/state1.restart 229228 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/state2.restart 799189 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/temp.dat 825384 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/vdw_E.dat 799074 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/vol.dat 80283 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/vol_dist_comp.png 10927 08-01-2018 10:09 ethane/pmatch/iter0/2-site/125K/vol_dist_comp.xvg 0 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/ 0 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/ETH_pmatch_150.2.o2285941 52 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/Q.dat 254728 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/aa_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/aa_vol_dist.xvg 250481 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/aa_volumes.xvg 297084 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/angle_E.dat 854205 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/bond_E.dat 250651 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/cg_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/cg_vol_dist.xvg 250459 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/cg_volumes.xvg 88074 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/cgethane.data 3308 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/cgethane.lmp 618 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/config.ini 297084 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/coul_E.dat 882297 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/enthalpy.dat 588 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/error_aa_vol_dist.xvg 588 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/error_cg_vol_dist.xvg 18 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/g_cnt.dat 854185 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/kinetic_E.dat 51426 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/lammps_bond_CT-CT.table 116660 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/lammps_nb_CT-CT.table 2104844 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/log.lammps 79 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/log.txt 2102099 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/out.dat 184558248 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/outfile.xtc 882205 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/potential_E.dat 868562 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/press.dat 3973576 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/press_tens.dat 75 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/psi.dat 75 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/psi_old.dat 285 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/qsub.sh 3463 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/restart.lmp 229228 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/state1.restart 229228 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/state2.restart 854230 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/temp.dat 882284 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/vdw_E.dat 854251 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/vol.dat 81541 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/vol_dist_comp.png 10897 08-01-2018 10:09 ethane/pmatch/iter0/2-site/150K/vol_dist_comp.xvg 0 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/ 0 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/ETH_pmatch_175.2.o2285952 0 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/ETH_pmatch_175.2.o2285961 0 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/ETH_pmatch_175.2.o2285978 53 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/Q.dat 254749 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/aa_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/aa_vol_dist.xvg 250488 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/aa_volumes.xvg 304014 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/angle_E.dat 873750 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/bond_E.dat 251096 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/cg_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/cg_vol_dist.xvg 250489 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/cg_volumes.xvg 88124 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/cgethane.data 3308 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/cgethane.lmp 618 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/config.ini 304014 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/coul_E.dat 902294 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/enthalpy.dat 588 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/error_aa_vol_dist.xvg 588 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/error_cg_vol_dist.xvg 18 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/g_cnt.dat 873720 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/kinetic_E.dat 51518 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/lammps_bond_CT-CT.table 116692 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/lammps_nb_CT-CT.table 2152094 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/log.lammps 79 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/log.txt 2149349 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/out.dat 188780920 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/outfile.xtc 902403 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/potential_E.dat 888219 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/press.dat 4069802 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/press_tens.dat 76 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/psi.dat 75 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/psi_old.dat 285 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/qsub.sh 3533 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/restart-part2.lmp 3463 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/restart.lmp 229228 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/state1.restart 229228 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/state2.restart 873724 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/temp.dat 902331 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/vdw_E.dat 873653 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/vol.dat 82223 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/vol_dist_comp.png 10852 08-01-2018 10:09 ethane/pmatch/iter0/2-site/175K/vol_dist_comp.xvg 0 08-01-2018 10:10 ethane/pmatch/iter1/ 0 08-01-2018 10:10 ethane/pmatch/iter1/1-site/ 0 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/ 18 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/ETH_pmatch_100.1.o3153625 42 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/Q.dat 254611 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/aa_pressures.xvg 202651 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/aa_pv.dat 399 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/aa_vol_dist.xvg 250472 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/aa_volumes.xvg 318930 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/angle_E.dat 318930 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/bond_E.dat 930783 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/cg_pressures.dat 608448 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/cg_pv.dat 399 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/cg_vol_dist.xvg 915541 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/cg_volumes.dat 37657 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/cgethane.data 3293 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/cgethane.lmp 634 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/config.ini 318930 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/coul_E.dat 915534 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/enthalpy.dat 588 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/g_cnt.dat 87182 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/iterative_improvement.png 12488 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/iterative_improvement.xvg 915616 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/kinetic_E.dat 116424 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/lammps_nb_CA-CA.table 2254322 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/log.txt 2251918 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/out.dat 118269652 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/outfile.xtc 915608 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/potential_E.dat 930874 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/press.dat 4245917 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/press_tens.dat 75 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/psi.dat 285 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/qsub.sh 21703 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/rdf_CA-CA.xvg 108670 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/state1.restart 108670 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/state2.restart 915542 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/temp.dat 915608 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/vdw_E.dat 915618 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/vol.dat 83417 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/vol_dist_comp.png 10840 08-01-2018 10:10 ethane/pmatch/iter1/1-site/100K/vol_dist_comp.xvg 0 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/ 18 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/ETH_pmatch_125.1.o3153626 42 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/Q.dat 254728 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/aa_pressures.xvg 202670 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/aa_pv.dat 399 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/aa_vol_dist.xvg 250487 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/aa_volumes.xvg 318930 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/angle_E.dat 318930 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/bond_E.dat 930918 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/cg_pressures.dat 608464 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/cg_pv.dat 399 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/cg_vol_dist.xvg 915572 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/cg_volumes.dat 37674 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/cgethane.data 3294 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/cgethane.lmp 634 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/config.ini 318930 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/coul_E.dat 915671 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/enthalpy.dat 588 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/g_cnt.dat 73503 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/iterative_improvement.png 12559 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/iterative_improvement.xvg 915559 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/kinetic_E.dat 116462 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/lammps_nb_CA-CA.table 2254324 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/log.txt 2251919 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/out.dat 118448552 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/outfile.xtc 915594 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/potential_E.dat 930921 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/press.dat 4246091 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/press_tens.dat 76 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/psi.dat 285 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/qsub.sh 22106 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/rdf_CA-CA.xvg 108670 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/state1.restart 108670 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/state2.restart 915633 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/temp.dat 915594 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/vdw_E.dat 915614 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/vol.dat 65350 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/vol_dist_comp.png 10912 08-01-2018 10:10 ethane/pmatch/iter1/1-site/125K/vol_dist_comp.xvg 0 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/ 18 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/ETH_pmatch_150.1.o3153627 42 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/Q.dat 254728 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/aa_pressures.xvg 202643 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/aa_pv.dat 399 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/aa_vol_dist.xvg 250481 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/aa_volumes.xvg 318930 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/angle_E.dat 318930 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/bond_E.dat 930992 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/cg_pressures.dat 608908 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/cg_pv.dat 399 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/cg_vol_dist.xvg 915552 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/cg_volumes.dat 37681 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/cgethane.data 3293 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/cgethane.lmp 634 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/config.ini 318930 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/coul_E.dat 942660 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/enthalpy.dat 588 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/g_cnt.dat 82523 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/iterative_improvement.png 12521 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/iterative_improvement.xvg 915592 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/kinetic_E.dat 116568 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/lammps_nb_CA-CA.table 2254316 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/log.txt 2251912 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/out.dat 118584496 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/outfile.xtc 945574 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/potential_E.dat 931093 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/press.dat 4246110 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/press_tens.dat 75 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/psi.dat 285 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/qsub.sh 22451 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/rdf_CA-CA.xvg 108670 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/state1.restart 108670 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/state2.restart 915694 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/temp.dat 945574 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/vdw_E.dat 915625 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/vol.dat 71717 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/vol_dist_comp.png 10863 08-01-2018 10:10 ethane/pmatch/iter1/1-site/150K/vol_dist_comp.xvg 0 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/ 18 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/ETH_pmatch_175.1.o3153629 42 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/Q.dat 254749 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/aa_pressures.xvg 399 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/aa_vol_dist.xvg 250488 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/aa_volumes.xvg 318930 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/angle_E.dat 318930 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/bond_E.dat 930944 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/cg_pressures.dat 399 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/cg_vol_dist.xvg 915563 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/cg_volumes.dat 37688 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/cgethane.data 3294 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/cgethane.lmp 634 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/config.ini 318930 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/coul_E.dat 945626 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/enthalpy.dat 588 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/g_cnt.dat 94288 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/iterative_improvement.png 12499 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/iterative_improvement.xvg 915629 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/kinetic_E.dat 116628 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/lammps_nb_CA-CA.table 2254317 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/log.txt 2251912 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/out.dat 118940768 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/outfile.xtc 945670 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/potential_E.dat 931047 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/press.dat 4246149 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/press_tens.dat 76 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/psi.dat 285 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/qsub.sh 108670 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/state1.restart 108670 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/state2.restart 915569 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/temp.dat 945670 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/vdw_E.dat 915578 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/vol.dat 92424 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/vol_dist_comp.png 10848 08-01-2018 10:10 ethane/pmatch/iter1/1-site/175K/vol_dist_comp.xvg 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/ 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/ 18 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/ETHpmatch_100.2.o2310556 42 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/Q.dat 254611 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/aa_pressures.xvg 399 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/aa_vol_dist.xvg 250472 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/aa_volumes.xvg 301088 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/angle_E.dat 865475 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/bond_E.dat 849753 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/cg_pressures.dat 399 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/cg_vol_dist.xvg 835947 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/cg_volumes.dat 88024 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/cgethane.data 3308 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/cgethane.lmp 635 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/config.ini 301088 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/coul_E.dat 893863 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/enthalpy.dat 588 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/g_cnt.dat 90139 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/iterative_improvement.png 12485 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/iterative_improvement.xvg 865493 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/kinetic_E.dat 51189 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/lammps_bond_CT-CT.table 116550 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/lammps_nb_CT-CT.table 2132144 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/log.txt 2129399 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/out.dat 187105696 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/outfile.xtc 893819 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/potential_E.dat 879786 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/press.dat 4014429 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/press_tens.dat 76 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/psi.dat 284 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/qsub.sh 229228 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/state1.restart 229228 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/state2.restart 865551 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/temp.dat 893825 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/vdw_E.dat 865587 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/vol.dat 81095 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/vol_dist_comp.png 10843 08-01-2018 10:10 ethane/pmatch/iter1/2-site/100K/vol_dist_comp.xvg 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/ 18 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/ETHpmatch_125.2.o2310564 42 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/Q.dat 254728 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/aa_pressures.xvg 399 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/aa_vol_dist.xvg 250487 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/aa_volumes.xvg 298525 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/angle_E.dat 858323 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/bond_E.dat 812411 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/cg_pressures.dat 399 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/cg_vol_dist.xvg 799074 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/cg_volumes.dat 88074 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/cgethane.data 3309 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/cgethane.lmp 635 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/config.ini 298525 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/coul_E.dat 886456 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/enthalpy.dat 588 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/g_cnt.dat 84126 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/iterative_improvement.png 12582 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/iterative_improvement.xvg 858321 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/kinetic_E.dat 51630 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/lammps_bond_CT-CT.table 116589 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/lammps_nb_CT-CT.table 2114670 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/log.txt 2111924 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/out.dat 185462120 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/outfile.xtc 886495 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/potential_E.dat 872435 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/press.dat 3986127 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/press_tens.dat 76 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/psi.dat 284 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/qsub.sh 229228 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/state1.restart 229228 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/state2.restart 858136 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/temp.dat 886436 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/vdw_E.dat 858232 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/vol.dat 75596 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/vol_dist_comp.png 10926 08-01-2018 10:10 ethane/pmatch/iter1/2-site/125K/vol_dist_comp.xvg 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/ 18 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/ETHpmatch_150.2.o2310576 42 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/Q.dat 254728 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/aa_pressures.xvg 399 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/aa_vol_dist.xvg 250481 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/aa_volumes.xvg 309228 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/angle_E.dat 888417 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/bond_E.dat 868562 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/cg_pressures.dat 399 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/cg_vol_dist.xvg 854251 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/cg_volumes.dat 88074 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/cgethane.data 3307 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/cgethane.lmp 635 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/config.ini 309228 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/coul_E.dat 917471 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/enthalpy.dat 588 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/g_cnt.dat 89378 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/iterative_improvement.png 12550 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/iterative_improvement.xvg 888332 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/kinetic_E.dat 51426 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/lammps_bond_CT-CT.table 116660 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/lammps_nb_CT-CT.table 2187643 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/log.txt 2184899 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/out.dat 191823708 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/outfile.xtc 917500 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/potential_E.dat 902852 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/press.dat 4163244 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/press_tens.dat 75 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/psi.dat 284 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/qsub.sh 229228 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/state1.restart 229228 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/state2.restart 888418 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/temp.dat 917510 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/vdw_E.dat 888429 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/vol.dat 91223 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/vol_dist_comp.png 10897 08-01-2018 10:10 ethane/pmatch/iter1/2-site/150K/vol_dist_comp.xvg 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/ 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/ETHpmatch_175.2.o2313070 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/ETHpmatch_175.2.o2313093 254749 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/aa_pressures.xvg 399 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/aa_vol_dist.xvg 250488 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/aa_volumes.xvg 318930 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/angle_E.dat 915608 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/bond_E.dat 399 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/cg_vol_dist.xvg 88124 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/cgethane.data 3289 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/cgethane.lmp 635 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/config.ini 318930 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/coul_E.dat 945586 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/enthalpy.dat 588 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/error_cg_vol_dist.xvg 95274 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/iterative_improvement.png 12507 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/iterative_improvement.xvg 915532 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/kinetic_E.dat 51518 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/lammps_bond_CT-CT.table 116692 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/lammps_nb_CT-CT.table 2254424 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/log.txt 2251696 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/out.dat 197975192 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/outfile.xtc 945703 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/potential_E.dat 930722 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/press.dat 4289544 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/press_tens.dat 284 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/qsub.sh 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/ 18 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/ETHpmatch_175.2.o2310589 42 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/Q.dat 318930 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/angle_E.dat 918930 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/bond_E.dat 888219 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/cg_pressures.dat 873653 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/cg_volumes.dat 318930 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/coul_E.dat 408982 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/enthalpy.dat 18 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/g_cnt.dat 408981 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/kinetic_E.dat 2251641 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/out.dat 918931 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/potential_E.dat 378988 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/press.dat 1159257 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/press_tens.dat 77 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/psi.dat 408983 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/temp.dat 318993 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/vdw_E.dat 408982 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/something_funny/vol.dat 229228 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/state1.restart 229228 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/state2.restart 915611 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/temp.dat 945636 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/vdw_E.dat 915505 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/vol.dat 86755 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/vol_dist_comp.png 10855 08-01-2018 10:10 ethane/pmatch/iter1/2-site/175K/vol_dist_comp.xvg 0 08-01-2018 10:10 ethane/pmatch/iter2/ 0 08-01-2018 10:10 ethane/pmatch/iter2/1-site/ 0 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/ 18 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/CG_g_cnt.dat 42 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/Q.dat 254611 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/aa_pressures.xvg 399 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/aa_vol_dist.xvg 250472 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/aa_volumes.xvg 306984 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/angle_E.dat 306984 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/bond_E.dat 930874 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/cg_pressures.dat 399 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/cg_vol_dist.xvg 915618 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/cg_volumes.dat 37657 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/cgethane.data 3293 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/cgethane.lmp 634 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/config.ini 306984 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/coul_E.dat 882122 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/enthalpy.dat 588 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/g_cnt.dat 86693 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/iterative_improvement.png 14178 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/iterative_improvement.xvg 881942 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/kinetic_E.dat 116424 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/lammps_nb_CA-CA.table 2361 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/log.txt 2169837 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/out.dat 1174 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/out_restart.dat 113770496 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/outfile.xtc 882038 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/potential_E.dat 897011 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/press.dat 4092409 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/press_tens.dat 75 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/psi.dat 292 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/qsub.sh 3391 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/restart.lmp 108670 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/state1.restart 108670 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/state2.restart 882066 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/temp.dat 882038 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/vdw_E.dat 882098 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/vol.dat 83418 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/vol_dist_comp.png 10839 08-01-2018 10:10 ethane/pmatch/iter2/1-site/100K/vol_dist_comp.xvg 0 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/ 18 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/ETH_pmatch_175.1.o3193854 42 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/Q.dat 254749 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/aa_pressures.xvg 202546 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/aa_pv.dat 399 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/aa_vol_dist.xvg 250488 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/aa_volumes.xvg 318930 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/angle_E.dat 318930 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/bond_E.dat 931047 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/cg_pressures.dat 608644 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/cg_pv.dat 9210 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/cg_vol_dist.xvg 915578 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/cg_volumes.dat 37688 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/cgethane.data 3294 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/cgethane.lmp 634 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/config.ini 318930 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/coul_E.dat 945712 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/enthalpy.dat 588 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/g_cnt.dat 106217 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/iterative_improvement.png 14197 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/iterative_improvement.xvg 915564 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/kinetic_E.dat 116628 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/lammps_nb_CA-CA.table 2254320 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/log.txt 2251915 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/out.dat 118938284 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/outfile.xtc 945580 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/potential_E.dat 930963 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/press.dat 4245745 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/press_tens.dat 76 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/psi.dat 285 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/qsub.sh 22885 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/rdf_CA-CA.xvg 108670 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/state1.restart 108670 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/state2.restart 915676 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/temp.dat 945580 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/vdw_E.dat 915633 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/vol.dat 92030 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/vol_dist_comp.png 10842 08-01-2018 10:10 ethane/pmatch/iter2/1-site/175K/vol_dist_comp.xvg 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/ 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/ 18 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/ETHpmatch_100.2.o2361218 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/ETHpmatch_100.2.o2363198 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/ETHpmatch_100.2.o2391980 42 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/Q.dat 254611 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/aa_pressures.xvg 399 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/aa_vol_dist.xvg 250472 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/aa_volumes.xvg 277526 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/angle_E.dat 41660 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/angle_E_restart.dat 799315 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/bond_E.dat 116925 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/bond_E_restart.dat 879786 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/cg_pressures.dat 399 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/cg_vol_dist.xvg 865587 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/cg_volumes.dat 88024 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/cgethane.data 3308 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/cgethane.lmp 635 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/config.ini 277526 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/coul_E.dat 41660 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/coul_E_restart.dat 825438 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/enthalpy.dat 120716 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/enthalpy_restart.dat 588 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/g_cnt.dat 110493 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/iterative_improvement.png 14186 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/iterative_improvement.xvg 799418 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/kinetic_E.dat 116957 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/kinetic_E_restart.dat 51189 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/lammps_bond_CT-CT.table 116550 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/lammps_nb_CT-CT.table 288392 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/log.txt 1968747 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/out.dat 285548 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/out_restart.dat 24951372 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/outfile.xtc 825615 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/potential_E.dat 120747 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/potential_E_restart.dat 812528 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/press.dat 930680 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/press_cat.dat 118818 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/press_restart.dat 3710747 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/press_tens.dat 536777 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/press_tens_restart.dat 76 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/psi.dat 291 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/qsub.sh 3387 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/restart.lmp 229228 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/state1.restart 229228 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/state1_rs.restart 229228 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/state2.restart 229228 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/state2_rs.restart 799284 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/temp.dat 915563 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/temp_cat.dat 116935 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/temp_restart.dat 825592 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/vdw_E.dat 120699 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/vdw_E_restart.dat 799398 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/vol.dat 915637 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/vol_cat.dat 85228 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/vol_dist_comp.png 10842 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/vol_dist_comp.xvg 116891 08-01-2018 10:10 ethane/pmatch/iter2/2-site/100K/vol_restart.dat 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/ 18 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/ETHpmatch_125.2.o2363165 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/ETHpmatch_125.2.o2391982 42 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/Q.dat 254728 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/aa_pressures.xvg 399 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/aa_vol_dist.xvg 250487 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/aa_volumes.xvg 317203 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/angle_E.dat 1983 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/angle_E_restart.dat 910778 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/bond_E.dat 5503 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/bond_E_restart.dat 872435 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/cg_pressures.dat 399 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/cg_vol_dist.xvg 858232 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/cg_volumes.dat 88074 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/cgethane.data 3309 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/cgethane.lmp 635 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/config.ini 317203 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/coul_E.dat 1983 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/coul_E_restart.dat 940597 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/enthalpy.dat 5676 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/enthalpy_restart.dat 588 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/g_cnt.dat 96165 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/iterative_improvement.png 14273 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/iterative_improvement.xvg 910760 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/kinetic_E.dat 5502 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/kinetic_E_restart.dat 51630 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/lammps_bond_CT-CT.table 116589 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/lammps_nb_CT-CT.table 17866 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/log.txt 2239271 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/out.dat 15022 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/out_restart.dat 1173372 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/outfile.xtc 940583 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/potential_E.dat 5678 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/potential_E_restart.dat 925766 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/press.dat 930689 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/press_cat.dat 5587 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/press_restart.dat 4226912 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/press_tens.dat 25223 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/press_tens_restart.dat 76 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/psi.dat 291 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/qsub.sh 3387 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/restart.lmp 229228 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/state1.restart 229228 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/state1_rs.restart 229228 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/state2.restart 229228 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/state2_rs.restart 910742 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/temp.dat 915598 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/temp_cat.dat 5514 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/temp_restart.dat 940549 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/vdw_E.dat 5680 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/vdw_E_restart.dat 910736 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/vol.dat 915587 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/vol_cat.dat 91195 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/vol_dist_comp.png 10936 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/vol_dist_comp.xvg 5507 08-01-2018 10:10 ethane/pmatch/iter2/2-site/125K/vol_restart.dat 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/ 18 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/ETHpmatch_150.2.o2363211 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/ETHpmatch_150.2.o2391987 42 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/Q.dat 254728 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/aa_pressures.xvg 399 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/aa_vol_dist.xvg 250481 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/aa_volumes.xvg 311142 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/angle_E.dat 8044 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/angle_E_restart.dat 893840 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/bond_E.dat 22519 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/bond_E_restart.dat 902852 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/cg_pressures.dat 399 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/cg_vol_dist.xvg 888429 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/cg_volumes.dat 88074 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/cgethane.data 3306 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/cgethane.lmp 635 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/config.ini 311142 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/coul_E.dat 8044 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/coul_E_restart.dat 923067 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/enthalpy.dat 23264 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/enthalpy_restart.dat 588 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/g_cnt.dat 102786 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/iterative_improvement.png 14245 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/iterative_improvement.xvg 893832 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/kinetic_E.dat 22519 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/kinetic_E_restart.dat 51426 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/lammps_bond_CT-CT.table 116660 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/lammps_nb_CT-CT.table 59190 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/log.txt 2197948 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/out.dat 56349 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/out_restart.dat 4802280 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/outfile.xtc 923112 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/potential_E.dat 23242 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/potential_E_restart.dat 908467 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/press.dat 930688 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/press_cat.dat 22885 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/press_restart.dat 4182593 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/press_tens.dat 104247 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/press_tens_restart.dat 73 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/psi.dat 291 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/qsub.sh 3384 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/restart.lmp 229228 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/state1.restart 229228 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/state1_rs.restart 229228 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/state2.restart 229228 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/state2_rs.restart 893740 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/temp.dat 915610 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/temp_cat.dat 22527 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/temp_restart.dat 923050 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/vdw_E.dat 23263 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/vdw_E_restart.dat 893697 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/vol.dat 915570 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/vol_cat.dat 82261 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/vol_dist_comp.png 10904 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/vol_dist_comp.xvg 22527 08-01-2018 10:10 ethane/pmatch/iter2/2-site/150K/vol_restart.dat 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/ 18 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/ETHpmatch_175.2.o2363260 42 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/Q.dat 254749 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/aa_pressures.xvg 399 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/aa_vol_dist.xvg 250488 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/aa_volumes.xvg 318930 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/angle_E.dat 915585 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/bond_E.dat 930722 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/cg_pressures.dat 399 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/cg_vol_dist.xvg 915505 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/cg_volumes.dat 88124 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/cgethane.data 3299 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/cgethane.lmp 636 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/config.ini 318930 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/coul_E.dat 945649 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/enthalpy.dat 588 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/g_cnt.dat 104125 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/iterative_improvement.png 14190 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/iterative_improvement.xvg 915579 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/kinetic_E.dat 51518 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/lammps_bond_CT-CT.table 116692 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/lammps_nb_CT-CT.table 2254435 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/log.txt 2251699 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/out.dat 197973496 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/outfile.xtc 945610 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/potential_E.dat 930672 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/press.dat 4285832 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/press_tens.dat 76 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/psi.dat 284 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/qsub.sh 229228 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/state1.restart 229228 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/state2.restart 915716 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/temp.dat 945643 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/vdw_E.dat 915487 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/vol.dat 86187 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/vol_dist_comp.png 10848 08-01-2018 10:10 ethane/pmatch/iter2/2-site/175K/vol_dist_comp.xvg 0 08-01-2018 10:10 ethane/pmatch/iter3/ 0 08-01-2018 10:10 ethane/pmatch/iter3/1-site/ 0 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/ 18 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/ETH_pmatch_175.1.o3228238 42 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/Q.dat 254749 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/aa_pressures.xvg 399 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/aa_vol_dist.xvg 250488 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/aa_volumes.xvg 318930 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/angle_E.dat 318930 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/bond_E.dat 930963 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/cg_pressures.dat 399 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/cg_vol_dist.xvg 915633 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/cg_volumes.dat 37688 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/cgethane.data 3294 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/cgethane.lmp 634 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/config.ini 318930 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/coul_E.dat 945703 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/enthalpy.dat 588 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/g_cnt.dat 105161 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/iterative_improvement.png 15885 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/iterative_improvement.xvg 915576 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/kinetic_E.dat 116628 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/lammps_nb_CA-CA.table 2254320 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/log.txt 2251915 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/out.dat 118944908 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/outfile.xtc 945674 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/potential_E.dat 931003 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/press.dat 4245871 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/press_tens.dat 76 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/psi.dat 305 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/qsub.sh 108670 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/state1.restart 108670 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/state2.restart 915522 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/temp.dat 945674 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/vdw_E.dat 915475 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/vol.dat 85360 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/vol_dist_comp.png 10844 08-01-2018 10:10 ethane/pmatch/iter3/1-site/175K/vol_dist_comp.xvg 0 08-01-2018 10:10 ethane/pmatch/iter3/2-site/ 0 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/ 18 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/ETHpmatch_125.2.o2396111 0 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/ETHpmatch_125.2.o2462342 42 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/Q.dat 254728 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/aa_pressures.xvg 399 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/aa_vol_dist.xvg 250487 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/aa_volumes.xvg 299240 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/angle_E.dat 19946 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/angle_E_restart.dat 860204 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/bond_E.dat 55934 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/bond_E_restart.dat 925766 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/cg_pressures.dat 399 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/cg_vol_dist.xvg 910736 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/cg_volumes.dat 88074 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/cgethane.data 3309 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/cgethane.lmp 635 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/config.ini 299240 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/coul_E.dat 19946 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/coul_E_restart.dat 888544 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/enthalpy.dat 57737 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/enthalpy_restart.dat 588 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/g_cnt.dat 98133 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/iterative_improvement.png 15958 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/iterative_improvement.xvg 860291 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/kinetic_E.dat 55949 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/kinetic_E_restart.dat 51630 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/lammps_bond_CT-CT.table 116589 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/lammps_nb_CT-CT.table 140339 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/log.txt 2116798 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/out.dat 137494 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/out_restart.dat 11932600 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/outfile.xtc 888574 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/potential_E.dat 57777 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/potential_E_restart.dat 874370 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/press.dat 930584 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/press_cat.dat 56891 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/press_restart.dat 3994939 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/press_tens.dat 257034 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/press_tens_restart.dat 76 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/psi.dat 291 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/qsub.sh 3388 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/restart.lmp 229228 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/state1.restart 229228 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/state1_rs.restart 229228 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/state2.restart 229228 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/state2_rs.restart 860352 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/temp.dat 915653 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/temp_cat.dat 55957 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/temp_restart.dat 888569 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/vdw_E.dat 57757 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/vdw_E_restart.dat 860243 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/vol.dat 915517 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/vol_cat.dat 67705 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/vol_dist_comp.png 10919 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/vol_dist_comp.xvg 55929 08-01-2018 10:10 ethane/pmatch/iter3/2-site/125K/vol_restart.dat 0 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/ 18 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/ETHpmatch_150.2.o2404451 42 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/Q.dat 254728 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/aa_pressures.xvg 399 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/aa_vol_dist.xvg 250481 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/aa_volumes.xvg 318930 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/angle_E.dat 915689 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/bond_E.dat 930688 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/cg_pressures.dat 399 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/cg_vol_dist.xvg 915570 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/cg_volumes.dat 88074 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/cgethane.data 3308 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/cgethane.lmp 635 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/config.ini 318930 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/coul_E.dat 945682 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/enthalpy.dat 588 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/g_cnt.dat 90617 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/iterative_improvement.png 15933 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/iterative_improvement.xvg 915663 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/kinetic_E.dat 51426 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/lammps_bond_CT-CT.table 116660 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/lammps_nb_CT-CT.table 2254444 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/log.txt 2251697 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/out.dat 197624904 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/outfile.xtc 945676 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/potential_E.dat 930670 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/press.dat 4283349 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/press_tens.dat 75 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/psi.dat 284 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/qsub.sh 229228 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/state1.restart 229228 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/state2.restart 915697 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/temp.dat 945561 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/vdw_E.dat 915513 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/vol.dat 80908 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/vol_dist_comp.png 10903 08-01-2018 10:10 ethane/pmatch/iter3/2-site/150K/vol_dist_comp.xvg 0 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/ 18 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/AA_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/CG_Q.dat 18 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/CG_g_cnt.dat 0 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/ETHpmatch_175.2.o2391995 42 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/Q.dat 254749 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/aa_pressures.xvg 399 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/aa_vol_dist.xvg 250488 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/aa_volumes.xvg 318930 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/angle_E.dat 915590 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/bond_E.dat 930672 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/cg_pressures.dat 399 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/cg_vol_dist.xvg 915487 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/cg_volumes.dat 88124 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/cgethane.data 3307 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/cgethane.lmp 636 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/config.ini 318930 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/coul_E.dat 945477 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/enthalpy.dat 588 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/error_cg_vol_dist.xvg 18 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/g_cnt.dat 115878 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/iterative_improvement.png 15873 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/iterative_improvement.xvg 915635 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/kinetic_E.dat 51518 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/lammps_bond_CT-CT.table 116692 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/lammps_nb_CT-CT.table 2254443 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/log.lammps 158 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/log.txt 2251697 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/out.dat 197928168 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/outfile.xtc 945545 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/potential_E.dat 930690 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/press.dat 4298696 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/press_tens.dat 75 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/psi.dat 284 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/qsub.sh 229228 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/state1.restart 229228 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/state2.restart 915604 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/temp.dat 945590 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/vdw_E.dat 915649 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/vol.dat 89509 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/vol_dist_comp.png 10848 08-01-2018 10:10 ethane/pmatch/iter3/2-site/175K/vol_dist_comp.xvg 0 08-01-2018 10:09 ethane/pmatch/iter4/ 0 08-01-2018 10:09 ethane/pmatch/iter4/2-site/ 0 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/ 18 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/AA_g_cnt.dat 0 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/CG_Q.dat 18 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/CG_g_cnt.dat 0 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/ETHpmatch_150.2.o2462301 0 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/ETHpmatch_150.2.o2509386 42 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/Q.dat 254728 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/aa_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/aa_vol_dist.xvg 250481 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/aa_volumes.xvg 317467 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/angle_E.dat 1719 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/angle_E_restart.dat 911507 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/bond_E.dat 4760 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/bond_E_restart.dat 930670 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/cg_pressures.dat 399 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/cg_vol_dist.xvg 915513 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/cg_volumes.dat 88074 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/cgethane.data 3307 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/cgethane.lmp 635 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/config.ini 317467 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/coul_E.dat 1719 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/coul_E_restart.dat 941453 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/enthalpy.dat 4909 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/enthalpy_restart.dat 588 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/error_cg_vol_dist.xvg 18 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/g_cnt.dat 100382 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/iterative_improvement.png 17623 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/iterative_improvement.xvg 911473 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/kinetic_E.dat 4769 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/kinetic_E_restart.dat 51426 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/lammps_bond_CT-CT.table 116660 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/lammps_nb_CT-CT.table 16066 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/log.lammps 158 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/log.txt 2241074 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/out.dat 13222 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/out_restart.dat 1014480 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/outfile.xtc 941463 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/potential_E.dat 4914 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/potential_E_restart.dat 926522 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/press.dat 930691 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/press_cat.dat 4839 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/press_restart.dat 4262941 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/press_tens.dat 21947 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/press_tens_restart.dat 74 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/psi.dat 291 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/qsub.sh 3385 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/restart.lmp 229228 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/state1.restart 229228 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/state1_rs.restart 229228 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/state2.restart 229228 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/state2_rs.restart 911328 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/temp.dat 915428 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/temp_cat.dat 4757 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/temp_restart.dat 941416 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/vdw_E.dat 4921 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/vdw_E_restart.dat 911461 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/vol.dat 915564 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/vol_cat.dat 74360 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/vol_dist_comp.png 10894 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/vol_dist_comp.xvg 4760 08-01-2018 10:09 ethane/pmatch/iter4/2-site/150K/vol_restart.dat 0 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/ 18 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/AA_g_cnt.dat 0 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/CG_Q.dat 18 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/CG_g_cnt.dat 0 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/ETHpmatch_175.2.o2462334 0 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/ETHpmatch_175.2.o2509388 42 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/Q.dat 254749 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/aa_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/aa_vol_dist.xvg 250488 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/aa_volumes.xvg 314321 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/angle_E.dat 4865 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/angle_E_restart.dat 902584 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/bond_E.dat 13602 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/bond_E_restart.dat 930690 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/cg_pressures.dat 399 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/cg_vol_dist.xvg 915649 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/cg_volumes.dat 88124 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/cgethane.data 3308 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/cgethane.lmp 635 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/config.ini 314321 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/coul_E.dat 4865 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/coul_E_restart.dat 932198 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/enthalpy.dat 14027 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/enthalpy_restart.dat 588 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/error_cg_vol_dist.xvg 18 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/g_cnt.dat 119620 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/iterative_improvement.png 17565 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/iterative_improvement.xvg 902645 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/kinetic_E.dat 13606 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/kinetic_E_restart.dat 51518 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/lammps_bond_CT-CT.table 116692 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/lammps_nb_CT-CT.table 37511 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/log.lammps 158 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/log.txt 2219624 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/out.dat 34666 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/out_restart.dat 2904208 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/outfile.xtc 932227 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/potential_E.dat 14042 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/potential_E_restart.dat 917489 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/press.dat 930627 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/press_cat.dat 13802 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/press_restart.dat 4235515 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/press_tens.dat 63019 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/press_tens_restart.dat 76 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/psi.dat 291 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/qsub.sh 3386 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/restart.lmp 229228 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/state1.restart 229228 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/state1_rs.restart 229228 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/state2.restart 229228 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/state2_rs.restart 902539 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/temp.dat 915489 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/temp_cat.dat 13607 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/temp_restart.dat 932391 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/vdw_E.dat 14043 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/vdw_E_restart.dat 902626 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/vol.dat 915557 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/vol_cat.dat 89279 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/vol_dist_comp.png 10853 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/vol_dist_comp.xvg 13587 08-01-2018 10:09 ethane/pmatch/iter4/2-site/175K/vol_restart.dat 0 08-01-2018 10:09 ethane/pmatch/iter5/ 0 08-01-2018 10:09 ethane/pmatch/iter5/2-site/ 0 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/ 18 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/AA_g_cnt.dat 0 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/CG_Q.dat 18 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/CG_g_cnt.dat 0 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/ETHpmatch_175.2.o2510442 42 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/Q.dat 254749 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/aa_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/aa_vol_dist.xvg 250488 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/aa_volumes.xvg 318930 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/angle_E.dat 915595 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/bond_E.dat 930627 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/cg_pressures.dat 399 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/cg_vol_dist.xvg 915557 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/cg_volumes.dat 88124 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/cgethane.data 3308 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/cgethane.lmp 635 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/config.ini 318930 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/coul_E.dat 945532 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/enthalpy.dat 588 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/error_cg_vol_dist.xvg 18 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/g_cnt.dat 128441 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/iterative_improvement.png 19248 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/iterative_improvement.xvg 915622 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/kinetic_E.dat 51518 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/lammps_bond_CT-CT.table 116692 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/lammps_nb_CT-CT.table 2254442 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/log.lammps 158 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/log.txt 2251697 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/out.dat 197950444 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/outfile.xtc 945665 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/potential_E.dat 930671 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/press.dat 4294878 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/press_tens.dat 76 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/psi.dat 284 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/qsub.sh 229228 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/state1.restart 229228 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/state2.restart 915598 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/temp.dat 945618 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/vdw_E.dat 915668 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/vol.dat 94179 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/vol_dist_comp.png 10848 08-01-2018 10:09 ethane/pmatch/iter5/2-site/175K/vol_dist_comp.xvg 0 08-01-2018 10:09 ethane/pmatch/iter6/ 0 08-01-2018 10:09 ethane/pmatch/iter6/2-site/ 0 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/ 18 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/AA_g_cnt.dat 0 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/CG_Q.dat 18 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/CG_g_cnt.dat 0 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/ETHpmatch_175.2.o2539306 42 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/Q.dat 254749 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/aa_pressures.xvg 399 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/aa_vol_dist.xvg 250488 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/aa_volumes.xvg 318930 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/angle_E.dat 915695 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/bond_E.dat 930671 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/cg_pressures.dat 399 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/cg_vol_dist.xvg 915668 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/cg_volumes.dat 88124 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/cgethane.data 3308 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/cgethane.lmp 635 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/config.ini 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930585 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/press.dat 4294586 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/press_tens.dat 76 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/psi.dat 284 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/qsub.sh 229228 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/state1.restart 229228 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/state2.restart 915510 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/temp.dat 945637 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/vdw_E.dat 915627 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/vol.dat 81589 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/vol_dist_comp.png 10857 08-01-2018 10:09 ethane/pmatch/iter6/2-site/175K/vol_dist_comp.xvg 10335 08-01-2018 10:09 ethane/pmatch/mdout.mdp 0 08-01-2018 10:09 ethane/pmatch/out.dat 56451 08-01-2018 10:09 ethane/pmatch/pressure_corrections.png 123355 08-01-2018 10:10 ethane/pmatch/pressure_corrections.xvg 3440 08-01-2018 10:09 ethane/pmatch/sample_aa_pv_eos_100.dat 1461 08-01-2018 10:09 ethane/pmatch/sample_aa_pv_eos_125.dat 2890 08-01-2018 10:09 ethane/pmatch/sample_aa_pv_eos_150.dat 7246 08-01-2018 10:10 ethane/pmatch/sample_aa_pv_eos_175.dat 1201 08-01-2018 10:09 ethane/pmatch/sample_cg_pv_eos_100.dat 1540 08-01-2018 10:09 ethane/pmatch/sample_cg_pv_eos_125.dat 2195 08-01-2018 10:09 ethane/pmatch/sample_cg_pv_eos_150.dat 2955 08-01-2018 10:10 ethane/pmatch/sample_cg_pv_eos_175.dat 40610 08-01-2018 10:09 ethane/pmatch/vol_list.dat 2887 08-01-2018 10:09 ethane/pmatch/xvg_distro.py 3807 08-01-2018 10:09 ethane/pmatch/xvg_trace.py 0 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/ 0 08-01-2018 10:14 ethane/predicted_CG_potls_howdotheydo/NPT/ 40224 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/cg_ethane.tpr 555567 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/density_100.dat 555490 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/density_110.dat 555616 08-01-2018 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ethane/predicted_CG_potls_howdotheydo/NPT/gen_potentials/run.make_tables.sh 291683 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/gen_potentials/table_CA_CA_100.xvg 291705 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/gen_potentials/table_CA_CA_110.xvg 291736 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/gen_potentials/table_CA_CA_125.xvg 291864 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/gen_potentials/table_CA_CA_150.xvg 291865 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/gen_potentials/table_CA_CA_165.xvg 291797 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/gen_potentials/table_CA_CA_175.xvg 0 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/run_100/ 21712 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/run_100/#rdf_CA-CA.xvg.1# 0 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/run_100/ETH_pmatch_100.o6565933 0 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/run_100/ETH_pmatch_100.o6565974 0 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/run_100/ETH_pmatch_100.o6566018 0 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/run_100/ETH_pmatch_100.o6585415 318930 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/run_100/angle_E.dat 318930 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/run_100/bond_E.dat 54796 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/run_100/cg_ethane.gro --------- ------- 6701821733 1540 files ===================================================== Content of ZIP archive ethane-21.zip ===================================================== Archive: ethane-21.zip Length Date Time Name --------- ---------- ----- ---- 1717857260 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/run_100/cg_ethane.trr 399 08-01-2018 10:13 ethane/predicted_CG_potls_howdotheydo/NPT/run_100/cg_vol_dist.xvg 37670 08-01-2018 10:13 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