examples/adress/hadress_tetraliquid/hadress_tetraliquid_plain/PressureProfile_Reference.dat | |
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examples/adress/hadress_tetraliquid/hadress_tetraliquid_plain/Tetracryst.py | 45 | F 1 wk |
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examples/adress/hadress_tetraliquid/hadress_tetraliquid_plain/equilibrated_conf.xyz | |
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examples/adress/hadress_tetraliquid/hadress_tetraliquid_plain/hadress.py | 170 | F 4 days |
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examples/adress/hadress_tetraliquid/hadress_tetraliquid_plain/table_potential.dat | |
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examples/adress/hadress_water/conf.gro | |
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examples/adress/hadress_water/equilibrated_conf.xyz | |
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examples/adress/hadress_water/grompp.mdp | |
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examples/adress/hadress_water/spcefw.itp | |
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examples/adress/hadress_water/table_CG_CG.tab | |
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examples/adress/hadress_water/table_CG_CG.xvg | |
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examples/adress/hadress_water/topol.top | |
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examples/adress/hadress_water/water.py | 148 | F 4 days |
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examples/adress/multiple_time_stepping_fadress/conf.gro | |
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examples/adress/multiple_time_stepping_fadress/table_ibi.dat | |
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examples/adress/multiple_time_stepping_fadress/table_tf.xvg | |
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examples/adress/multiple_time_stepping_fadress/topol.top | |
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examples/adress/multiple_time_stepping_fadress/water_mts_fadress.py | 165 | F 4 days |
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examples/adress/multiple_time_stepping_hadress/conf.gro | |
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examples/adress/multiple_time_stepping_hadress/table_fec.dat | |
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examples/adress/multiple_time_stepping_hadress/topol.top | |
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examples/adress/multiple_time_stepping_hadress/water_mts_hadress.py | 162 | A 0 mins |
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examples/adress/piadress_water/AdaptivePIwater.py | 310 | F 1 wk |
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examples/adress/piadress_water/FEC_H.dat | |
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examples/adress/piadress_water/FEC_O.dat | |
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examples/adress/piadress_water/POTS/tableESP_HW_HW.dat | |
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examples/adress/piadress_water/POTS/tableESP_HW_OW.dat | |
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examples/adress/piadress_water/POTS/tableESP_OW_OW.dat | |
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examples/adress/piadress_water/POTS/tableESP_angle.dat | |
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examples/adress/piadress_water/POTS/tableESP_bondHH.dat | |
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examples/adress/piadress_water/POTS/tableESP_bondOH.dat | |
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examples/adress/piadress_water/ThdForce_H.dat | |
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examples/adress/piadress_water/ThdForce_O.dat | |
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examples/adress/piadress_water/input.xyz | |
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examples/analyze_during_integration/analyze_during_integration.py | 23 | A 0 mins |
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examples/convert_gromacs_tables/convert_gromacs_table.py | 109 | D 2 days |
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examples/convert_gromacs_tables/table6-12.xvg | |
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examples/electrostatics/electrostatics_example.py | 112 | A 2 hrs |
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examples/ewald/ewald.espressopp | |
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examples/ewald/ewald.py | 97 | F 3 days |
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examples/ewald/ewald_result.dat | |
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examples/external_force/external_force.py | 29 | A 0 mins |
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examples/fix_particles/fix_particles.py | 21 | A 35 mins |
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examples/force_capping/force_capping.py | 21 | A 0 mins |
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examples/hierarchical_strategy_for_one-component/README | |
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examples/hierarchical_strategy_for_one-component/fbloop.py | 246 | B 4 hrs |
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examples/hierarchical_strategy_for_one-component/generate_microscopic-c.py | 108 | C 1 day |
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examples/hierarchical_strategy_for_one-component/input.txt | |
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examples/hierarchical_strategy_for_one-component/polymer_melt_from_restart.py | 143 | F 3 days |
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examples/hierarchical_strategy_for_one-component/reinsertion.py | 248 | F 6 days |
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