votca-tutorials (2025.1-1)
Details
Core information at a glance
- Distribution
- kali
- Origin
- kali-rolling
- Repository
- https://http.kali.org/kali
- Codename
- kali-rolling
- Component
- main
- Source
- votca
- Architecture
- i386
- Section
- science
- Priority
- optional
- Maintainer
- Debichem Team <[email protected]>
Size & integrity
Byte sizes and integrity verification
- Installed size
- 81.5 kB
- Size expected
- 18.2 MB
- Size actual
- 18.2 MB
- Size match
Suggested packages
Recommended additional packages
- None
Description
VOTCA molecular dynamics analysis - tutorials
Tags
Package classification tags
None
Checksums
Hash values and integrity verification status
| Type | Actual | Match |
|---|---|---|
| MD5 | a9b24107…fc6cb94f | |
| SHA-1 | 520b0ec3…da2d6236 | |
| SHA-256 | 2d7e25a6…e3f667ec | |
| SHA-512 | 49b07144…deafca81 |
Contents
Files and directories included
. usr usr/share usr/share/doc usr/share/doc/votca-tutorials usr/share/doc/votca-tutorials/changelog.Debian.gz usr/share/doc/votca-tutorials/changelog.gz usr/share/doc/votca-tutorials/copyright usr/share/lintian usr/share/lintian/overrides usr/share/lintian/overrides/votca-tutorials usr/share/votca usr/share/votca/csg-tutorials usr/share/votca/csg-tutorials/LJ1-LJ2 usr/share/votca/csg-tutorials/LJ1-LJ2/imc usr/share/votca/csg-tutorials/LJ1-LJ2/imc/LJ1-LJ1.dist.tgt usr/share/votca/csg-tutorials/LJ1-LJ2/imc/LJ1-LJ2.dist.tgt usr/share/votca/csg-tutorials/LJ1-LJ2/imc/LJ2-LJ2.dist.tgt usr/share/votca/csg-tutorials/LJ1-LJ2/imc/conf.gro usr/share/votca/csg-tutorials/LJ1-LJ2/imc/grompp.mdp usr/share/votca/csg-tutorials/LJ1-LJ2/imc/index.ndx usr/share/votca/csg-tutorials/LJ1-LJ2/imc/run.sh usr/share/votca/csg-tutorials/LJ1-LJ2/imc/settings.xml usr/share/votca/csg-tutorials/LJ1-LJ2/imc/settings_pre.xml usr/share/votca/csg-tutorials/LJ1-LJ2/imc/svd.py usr/share/votca/csg-tutorials/LJ1-LJ2/imc/table.xvg usr/share/votca/csg-tutorials/LJ1-LJ2/imc/topol.top usr/share/votca/csg-tutorials/README.rst usr/share/votca/csg-tutorials/hexane usr/share/votca/csg-tutorials/hexane/atomistic usr/share/votca/csg-tutorials/hexane/atomistic/boltzmann_cmds usr/share/votca/csg-tutorials/hexane/atomistic/conf.gro usr/share/votca/csg-tutorials/hexane/atomistic/grompp.mdp usr/share/votca/csg-tutorials/hexane/atomistic/hexane.xml usr/share/votca/csg-tutorials/hexane/atomistic/run.sh usr/share/votca/csg-tutorials/hexane/atomistic/run_Boltzmann.sh usr/share/votca/csg-tutorials/hexane/atomistic/settings.xml usr/share/votca/csg-tutorials/hexane/atomistic/topol.top usr/share/votca/csg-tutorials/hexane/force_matching usr/share/votca/csg-tutorials/hexane/force_matching/fmatch.xml usr/share/votca/csg-tutorials/hexane/force_matching/hexane.xml usr/share/votca/csg-tutorials/hexane/force_matching/run.sh usr/share/votca/csg-tutorials/hexane/hybrid_force_matching usr/share/votca/csg-tutorials/hexane/hybrid_force_matching/README usr/share/votca/csg-tutorials/hexane/hybrid_force_matching/fmatch.xml usr/share/votca/csg-tutorials/hexane/hybrid_force_matching/hexane.xml usr/share/votca/csg-tutorials/hexane/hybrid_force_matching/run.sh usr/share/votca/csg-tutorials/hexane/hybrid_force_matching/topol.top usr/share/votca/csg-tutorials/hexane/ibi_all usr/share/votca/csg-tutorials/hexane/ibi_all/A-A.dist.tgt usr/share/votca/csg-tutorials/hexane/ibi_all/A-B.dist.tgt usr/share/votca/csg-tutorials/hexane/ibi_all/B-B.dist.tgt usr/share/votca/csg-tutorials/hexane/ibi_all/angle.dist.tgt usr/share/votca/csg-tutorials/hexane/ibi_all/bond.dist.tgt usr/share/votca/csg-tutorials/hexane/ibi_all/conf.gro usr/share/votca/csg-tutorials/hexane/ibi_all/grompp.mdp usr/share/votca/csg-tutorials/hexane/ibi_all/hexane_cg.xml usr/share/votca/csg-tutorials/hexane/ibi_all/index.ndx usr/share/votca/csg-tutorials/hexane/ibi_all/run.sh usr/share/votca/csg-tutorials/hexane/ibi_all/settings.xml usr/share/votca/csg-tutorials/hexane/ibi_all/table.xvg usr/share/votca/csg-tutorials/hexane/ibi_all/topol.top usr/share/votca/csg-tutorials/hexane/ibi_nonbonded usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/A-A.dist.tgt usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/A-B.dist.tgt usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/B-B.dist.tgt usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/angle.xml usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/boltzmann_cmds usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/bond.xml usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/conf.gro usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/grompp.mdp usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/index.ndx usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/run.sh usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/run_Boltzmann.sh usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/settings.xml usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/table.xvg usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/table_a1.xvg usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/table_b1.xvg usr/share/votca/csg-tutorials/hexane/ibi_nonbonded/topol.top usr/share/votca/csg-tutorials/methanol usr/share/votca/csg-tutorials/methanol/atomistic usr/share/votca/csg-tutorials/methanol/atomistic/conf.gro usr/share/votca/csg-tutorials/methanol/atomistic/grompp.mdp usr/share/votca/csg-tutorials/methanol/atomistic/methanol.xml usr/share/votca/csg-tutorials/methanol/atomistic/methanol_opls.itp usr/share/votca/csg-tutorials/methanol/atomistic/run.sh usr/share/votca/csg-tutorials/methanol/atomistic/settings.xml usr/share/votca/csg-tutorials/methanol/atomistic/topol.top usr/share/votca/csg-tutorials/methanol/force_matching usr/share/votca/csg-tutorials/methanol/force_matching/fmatch.xml usr/share/votca/csg-tutorials/methanol/force_matching/methanol.xml usr/share/votca/csg-tutorials/methanol/force_matching/run.sh usr/share/votca/csg-tutorials/methanol/ibi usr/share/votca/csg-tutorials/methanol/ibi/conf.gro usr/share/votca/csg-tutorials/methanol/ibi/grompp.mdp usr/share/votca/csg-tutorials/methanol/ibi/index.ndx usr/share/votca/csg-tutorials/methanol/ibi/rdf_methanol.xvg usr/share/votca/csg-tutorials/methanol/ibi/run.sh usr/share/votca/csg-tutorials/methanol/ibi/settings.xml usr/share/votca/csg-tutorials/methanol/ibi/table.xvg usr/share/votca/csg-tutorials/methanol/ibi/topol.top usr/share/votca/csg-tutorials/methanol/imc usr/share/votca/csg-tutorials/methanol/imc/conf.gro usr/share/votca/csg-tutorials/methanol/imc/grompp.mdp usr/share/votca/csg-tutorials/methanol/imc/index.ndx usr/share/votca/csg-tutorials/methanol/imc/rdf_methanol.xvg usr/share/votca/csg-tutorials/methanol/imc/run.sh usr/share/votca/csg-tutorials/methanol/imc/settings.xml usr/share/votca/csg-tutorials/methanol/imc/table.xvg usr/share/votca/csg-tutorials/methanol/imc/topol.top usr/share/votca/csg-tutorials/methanol/imc_gromacs-remd usr/share/votca/csg-tutorials/methanol/imc_gromacs-remd/conf.gro usr/share/votca/csg-tutorials/methanol/imc_gromacs-remd/grompp.mdp usr/share/votca/csg-tutorials/methanol/imc_gromacs-remd/grompp0.mdp usr/share/votca/csg-tutorials/methanol/imc_gromacs-remd/grompp2.mdp usr/share/votca/csg-tutorials/methanol/imc_gromacs-remd/grompp3.mdp usr/share/votca/csg-tutorials/methanol/imc_gromacs-remd/index.ndx usr/share/votca/csg-tutorials/methanol/imc_gromacs-remd/rdf_methanol.xvg usr/share/votca/csg-tutorials/methanol/imc_gromacs-remd/run.sh usr/share/votca/csg-tutorials/methanol/imc_gromacs-remd/settings.xml usr/share/votca/csg-tutorials/methanol/imc_gromacs-remd/table.xvg usr/share/votca/csg-tutorials/methanol/imc_gromacs-remd/topol.top usr/share/votca/csg-tutorials/methanol-water usr/share/votca/csg-tutorials/methanol-water/X_0.062 usr/share/votca/csg-tutorials/methanol-water/X_0.062/atomistic usr/share/votca/csg-tutorials/methanol-water/X_0.062/atomistic/conf.gro usr/share/votca/csg-tutorials/methanol-water/X_0.062/atomistic/grompp.mdp usr/share/votca/csg-tutorials/methanol-water/X_0.062/atomistic/methanol.xml usr/share/votca/csg-tutorials/methanol-water/X_0.062/atomistic/methanol_opls.itp usr/share/votca/csg-tutorials/methanol-water/X_0.062/atomistic/run.sh usr/share/votca/csg-tutorials/methanol-water/X_0.062/atomistic/settings.xml usr/share/votca/csg-tutorials/methanol-water/X_0.062/atomistic/topol.top usr/share/votca/csg-tutorials/methanol-water/X_0.062/atomistic/water.xml usr/share/votca/csg-tutorials/methanol-water/X_0.062/re usr/share/votca/csg-tutorials/methanol-water/X_0.062/re/ME-ME.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.062/re/ME-ME.param.init usr/share/votca/csg-tutorials/methanol-water/X_0.062/re/ME-WT.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.062/re/ME-WT.param.init usr/share/votca/csg-tutorials/methanol-water/X_0.062/re/WT-WT.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.062/re/WT-WT.param.init usr/share/votca/csg-tutorials/methanol-water/X_0.062/re/conf.gro usr/share/votca/csg-tutorials/methanol-water/X_0.062/re/grompp.mdp usr/share/votca/csg-tutorials/methanol-water/X_0.062/re/index.ndx usr/share/votca/csg-tutorials/methanol-water/X_0.062/re/run.sh usr/share/votca/csg-tutorials/methanol-water/X_0.062/re/settings.xml usr/share/votca/csg-tutorials/methanol-water/X_0.062/re/table.xvg usr/share/votca/csg-tutorials/methanol-water/X_0.062/re/topol.top usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/ME-ME.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/ME-ME.simplex.in usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/ME-WT.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/ME-WT.simplex.in usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/WT-WT.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/WT-WT.simplex.in usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/conf.gro usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/function_CKDg_ME_ME.in usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/function_CKDg_ME_WT.in usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/function_CKDg_WT_WT.in usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/function_rdf_weight.in usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/grompp.mdp usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/grompp.prep.mdp usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/index.ndx usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/run.sh usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/settings.xml usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/table.xvg usr/share/votca/csg-tutorials/methanol-water/X_0.062/simplex/topol.top usr/share/votca/csg-tutorials/methanol-water/X_0.5 usr/share/votca/csg-tutorials/methanol-water/X_0.5/atomistic usr/share/votca/csg-tutorials/methanol-water/X_0.5/atomistic/conf.gro usr/share/votca/csg-tutorials/methanol-water/X_0.5/atomistic/grompp.mdp usr/share/votca/csg-tutorials/methanol-water/X_0.5/atomistic/methanol.xml usr/share/votca/csg-tutorials/methanol-water/X_0.5/atomistic/methanol_opls.itp usr/share/votca/csg-tutorials/methanol-water/X_0.5/atomistic/run.sh usr/share/votca/csg-tutorials/methanol-water/X_0.5/atomistic/settings.xml usr/share/votca/csg-tutorials/methanol-water/X_0.5/atomistic/topol.top usr/share/votca/csg-tutorials/methanol-water/X_0.5/atomistic/water.xml usr/share/votca/csg-tutorials/methanol-water/X_0.5/re usr/share/votca/csg-tutorials/methanol-water/X_0.5/re/ME-ME.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.5/re/ME-ME.param.init usr/share/votca/csg-tutorials/methanol-water/X_0.5/re/ME-WT.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.5/re/ME-WT.param.init usr/share/votca/csg-tutorials/methanol-water/X_0.5/re/WT-WT.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.5/re/WT-WT.param.init usr/share/votca/csg-tutorials/methanol-water/X_0.5/re/conf.gro usr/share/votca/csg-tutorials/methanol-water/X_0.5/re/grompp.mdp usr/share/votca/csg-tutorials/methanol-water/X_0.5/re/index.ndx usr/share/votca/csg-tutorials/methanol-water/X_0.5/re/run.sh usr/share/votca/csg-tutorials/methanol-water/X_0.5/re/settings.xml usr/share/votca/csg-tutorials/methanol-water/X_0.5/re/table.xvg usr/share/votca/csg-tutorials/methanol-water/X_0.5/re/topol.top usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/ME-ME.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/ME-ME.simplex.in usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/ME-WT.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/ME-WT.simplex.in usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/WT-WT.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/WT-WT.simplex.in usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/conf.gro usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/function_CKDg_ME_ME.in usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/function_CKDg_ME_WT.in usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/function_CKDg_WT_WT.in usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/function_rdf_weight.in usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/grompp.mdp usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/grompp.prep.mdp usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/index.ndx usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/run.sh usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/settings.xml usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/table.xvg usr/share/votca/csg-tutorials/methanol-water/X_0.5/simplex/topol.top usr/share/votca/csg-tutorials/methanol-water/X_0.938 usr/share/votca/csg-tutorials/methanol-water/X_0.938/atomistic usr/share/votca/csg-tutorials/methanol-water/X_0.938/atomistic/conf.gro usr/share/votca/csg-tutorials/methanol-water/X_0.938/atomistic/grompp.mdp usr/share/votca/csg-tutorials/methanol-water/X_0.938/atomistic/methanol.xml usr/share/votca/csg-tutorials/methanol-water/X_0.938/atomistic/methanol_opls.itp usr/share/votca/csg-tutorials/methanol-water/X_0.938/atomistic/run.sh usr/share/votca/csg-tutorials/methanol-water/X_0.938/atomistic/settings.xml usr/share/votca/csg-tutorials/methanol-water/X_0.938/atomistic/topol.top usr/share/votca/csg-tutorials/methanol-water/X_0.938/atomistic/water.xml usr/share/votca/csg-tutorials/methanol-water/X_0.938/re usr/share/votca/csg-tutorials/methanol-water/X_0.938/re/ME-ME.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.938/re/ME-ME.param.init usr/share/votca/csg-tutorials/methanol-water/X_0.938/re/ME-WT.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.938/re/ME-WT.param.init usr/share/votca/csg-tutorials/methanol-water/X_0.938/re/WT-WT.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.938/re/WT-WT.param.init usr/share/votca/csg-tutorials/methanol-water/X_0.938/re/conf.gro usr/share/votca/csg-tutorials/methanol-water/X_0.938/re/grompp.mdp usr/share/votca/csg-tutorials/methanol-water/X_0.938/re/index.ndx usr/share/votca/csg-tutorials/methanol-water/X_0.938/re/run.sh usr/share/votca/csg-tutorials/methanol-water/X_0.938/re/settings.xml usr/share/votca/csg-tutorials/methanol-water/X_0.938/re/table.xvg usr/share/votca/csg-tutorials/methanol-water/X_0.938/re/topol.top usr/share/votca/csg-tutorials/methanol-water/X_0.938/simplex usr/share/votca/csg-tutorials/methanol-water/X_0.938/simplex/ME-ME.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.938/simplex/ME-ME.simplex.in usr/share/votca/csg-tutorials/methanol-water/X_0.938/simplex/ME-WT.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.938/simplex/ME-WT.simplex.in usr/share/votca/csg-tutorials/methanol-water/X_0.938/simplex/WT-WT.aa.rdf usr/share/votca/csg-tutorials/methanol-water/X_0.938/simplex/WT-WT.simplex.in usr/share/votca/csg-tutorials/methanol-water/X_0.938/simplex/conf.gro usr/share/votca/csg-tutorials/methanol-water/X_0.938/simplex/function_CKDg_ME_ME.in usr/share/votca/csg-tutorials/methanol-water/X_0.938/simplex/function_CKDg_ME_WT.in usr/share/votca/csg-tutorials/methanol-water/X_0.938/simplex/function_CKDg_WT_WT.in usr/share/votca/csg-tutorials/methanol-water/X_0.938/simplex/function_rdf_weight.in usr/share/votca/csg-tutorials/methanol-water/X_0.938/simplex/grompp.mdp 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usr/share/votca/csg-tutorials/propane/imc/topol.top usr/share/votca/csg-tutorials/propane/imc-ibiintra usr/share/votca/csg-tutorials/propane/imc-ibiintra/A-A.pot.in usr/share/votca/csg-tutorials/propane/imc-ibiintra/A-B.pot.in usr/share/votca/csg-tutorials/propane/imc-ibiintra/B-B.pot.in usr/share/votca/csg-tutorials/propane/imc-ibiintra/README usr/share/votca/csg-tutorials/propane/imc-ibiintra/angle.pot.in usr/share/votca/csg-tutorials/propane/imc-ibiintra/bond.pot.in usr/share/votca/csg-tutorials/propane/imc-ibiintra/conf.gro usr/share/votca/csg-tutorials/propane/imc-ibiintra/grompp.mdp usr/share/votca/csg-tutorials/propane/imc-ibiintra/index.ndx usr/share/votca/csg-tutorials/propane/imc-ibiintra/map.xml usr/share/votca/csg-tutorials/propane/imc-ibiintra/pre usr/share/votca/csg-tutorials/propane/imc-ibiintra/pre/grompp.mdp usr/share/votca/csg-tutorials/propane/imc-ibiintra/pre/run.sh usr/share/votca/csg-tutorials/propane/imc-ibiintra/pre/settings.xml 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usr/share/votca/csg-tutorials/scripts/Extract_Energies.sh usr/share/votca/csg-tutorials/spce usr/share/votca/csg-tutorials/spce/3body_sw usr/share/votca/csg-tutorials/spce/3body_sw/calculate_distributions.xml usr/share/votca/csg-tutorials/spce/3body_sw/convert_tables.xml usr/share/votca/csg-tutorials/spce/3body_sw/fmatch.xml usr/share/votca/csg-tutorials/spce/3body_sw/run.sh usr/share/votca/csg-tutorials/spce/3body_sw/spce.data usr/share/votca/csg-tutorials/spce/3body_sw/spce.in usr/share/votca/csg-tutorials/spce/3body_sw/spce.sw usr/share/votca/csg-tutorials/spce/3body_sw/water.xml usr/share/votca/csg-tutorials/spce/atomistic usr/share/votca/csg-tutorials/spce/atomistic/conf.gro usr/share/votca/csg-tutorials/spce/atomistic/grompp.mdp usr/share/votca/csg-tutorials/spce/atomistic/run.sh usr/share/votca/csg-tutorials/spce/atomistic/settings.xml usr/share/votca/csg-tutorials/spce/atomistic/topol.top usr/share/votca/csg-tutorials/spce/atomistic/water.xml usr/share/votca/csg-tutorials/spce/cma usr/share/votca/csg-tutorials/spce/cma/density usr/share/votca/csg-tutorials/spce/cma/density/CG-CG.cma.in usr/share/votca/csg-tutorials/spce/cma/density/conf.gro usr/share/votca/csg-tutorials/spce/cma/density/dens_CG_CG_aim.xvg usr/share/votca/csg-tutorials/spce/cma/density/grompp.mdp usr/share/votca/csg-tutorials/spce/cma/density/grompp.prep.mdp usr/share/votca/csg-tutorials/spce/cma/density/index.ndx usr/share/votca/csg-tutorials/spce/cma/density/rdf_CG_CG_aim.xvg usr/share/votca/csg-tutorials/spce/cma/density/run.sh usr/share/votca/csg-tutorials/spce/cma/density/settings.xml usr/share/votca/csg-tutorials/spce/cma/density/table.xvg usr/share/votca/csg-tutorials/spce/cma/density/topol.top usr/share/votca/csg-tutorials/spce/cma/simple usr/share/votca/csg-tutorials/spce/cma/simple/CG-CG.cma.in usr/share/votca/csg-tutorials/spce/cma/simple/CG-CG.dist.tgt usr/share/votca/csg-tutorials/spce/cma/simple/conf.gro usr/share/votca/csg-tutorials/spce/cma/simple/function_CKDg.in usr/share/votca/csg-tutorials/spce/cma/simple/function_rdf_weight.in usr/share/votca/csg-tutorials/spce/cma/simple/grompp.mdp usr/share/votca/csg-tutorials/spce/cma/simple/grompp.prep.mdp usr/share/votca/csg-tutorials/spce/cma/simple/index.ndx usr/share/votca/csg-tutorials/spce/cma/simple/run.sh usr/share/votca/csg-tutorials/spce/cma/simple/settings.xml usr/share/votca/csg-tutorials/spce/cma/simple/table.xvg usr/share/votca/csg-tutorials/spce/cma/simple/topol.top usr/share/votca/csg-tutorials/spce/force_matching usr/share/votca/csg-tutorials/spce/force_matching/fmatch.xml usr/share/votca/csg-tutorials/spce/force_matching/run.sh usr/share/votca/csg-tutorials/spce/force_matching/water.xml usr/share/votca/csg-tutorials/spce/hncgn usr/share/votca/csg-tutorials/spce/hncgn/CG-CG.dist.tgt usr/share/votca/csg-tutorials/spce/hncgn/conf.gro usr/share/votca/csg-tutorials/spce/hncgn/grompp.mdp usr/share/votca/csg-tutorials/spce/hncgn/index.ndx usr/share/votca/csg-tutorials/spce/hncgn/settings.xml usr/share/votca/csg-tutorials/spce/hncgn/table.xvg usr/share/votca/csg-tutorials/spce/hncgn/topol.top usr/share/votca/csg-tutorials/spce/ibi usr/share/votca/csg-tutorials/spce/ibi/CG-CG.dist.tgt usr/share/votca/csg-tutorials/spce/ibi/conf.gro usr/share/votca/csg-tutorials/spce/ibi/grompp.mdp usr/share/votca/csg-tutorials/spce/ibi/index.ndx usr/share/votca/csg-tutorials/spce/ibi/run.sh usr/share/votca/csg-tutorials/spce/ibi/settings.xml usr/share/votca/csg-tutorials/spce/ibi/table.xvg usr/share/votca/csg-tutorials/spce/ibi/topol.top usr/share/votca/csg-tutorials/spce/ibi_dlpoly usr/share/votca/csg-tutorials/spce/ibi_dlpoly/CG-CG.dist.tgt usr/share/votca/csg-tutorials/spce/ibi_dlpoly/CONFIG usr/share/votca/csg-tutorials/spce/ibi_dlpoly/CONTROL usr/share/votca/csg-tutorials/spce/ibi_dlpoly/FIELD usr/share/votca/csg-tutorials/spce/ibi_dlpoly/OUTPUT usr/share/votca/csg-tutorials/spce/ibi_dlpoly/run.sh usr/share/votca/csg-tutorials/spce/ibi_dlpoly/settings.xml usr/share/votca/csg-tutorials/spce/ibi_espresso usr/share/votca/csg-tutorials/spce/ibi_espresso/CG-CG.dist.tgt usr/share/votca/csg-tutorials/spce/ibi_espresso/run.sh usr/share/votca/csg-tutorials/spce/ibi_espresso/settings.xml usr/share/votca/csg-tutorials/spce/ibi_espresso/spce.gro usr/share/votca/csg-tutorials/spce/ibi_espresso/spce.py usr/share/votca/csg-tutorials/spce/ibi_espresso/topol.xml usr/share/votca/csg-tutorials/spce/ibi_espressopp usr/share/votca/csg-tutorials/spce/ibi_espressopp/CG-CG.dist.tgt usr/share/votca/csg-tutorials/spce/ibi_espressopp/conf.gro usr/share/votca/csg-tutorials/spce/ibi_espressopp/run.sh usr/share/votca/csg-tutorials/spce/ibi_espressopp/settings.xml usr/share/votca/csg-tutorials/spce/ibi_espressopp/spce.py usr/share/votca/csg-tutorials/spce/ibi_espressopp/topol.xml usr/share/votca/csg-tutorials/spce/ibi_gromacs-multi usr/share/votca/csg-tutorials/spce/ibi_gromacs-multi/CG-CG.dist.tgt usr/share/votca/csg-tutorials/spce/ibi_gromacs-multi/conf.gro usr/share/votca/csg-tutorials/spce/ibi_gromacs-multi/grompp.mdp usr/share/votca/csg-tutorials/spce/ibi_gromacs-multi/index.ndx usr/share/votca/csg-tutorials/spce/ibi_gromacs-multi/run.sh usr/share/votca/csg-tutorials/spce/ibi_gromacs-multi/settings.xml usr/share/votca/csg-tutorials/spce/ibi_gromacs-multi/table.xvg usr/share/votca/csg-tutorials/spce/ibi_gromacs-multi/topol.top usr/share/votca/csg-tutorials/spce/ibi_hoomd-blue usr/share/votca/csg-tutorials/spce/ibi_hoomd-blue/CG-CG.dist.tgt usr/share/votca/csg-tutorials/spce/ibi_hoomd-blue/conf.gro usr/share/votca/csg-tutorials/spce/ibi_hoomd-blue/run.sh usr/share/votca/csg-tutorials/spce/ibi_hoomd-blue/settings.xml usr/share/votca/csg-tutorials/spce/ibi_hoomd-blue/spce.py usr/share/votca/csg-tutorials/spce/ibi_hoomd-blue/topol.xml usr/share/votca/csg-tutorials/spce/ibi_lammps usr/share/votca/csg-tutorials/spce/ibi_lammps/CG-CG.dist.tgt usr/share/votca/csg-tutorials/spce/ibi_lammps/run.sh usr/share/votca/csg-tutorials/spce/ibi_lammps/settings.xml usr/share/votca/csg-tutorials/spce/ibi_lammps/spce.data usr/share/votca/csg-tutorials/spce/ibi_lammps/spce.in usr/share/votca/csg-tutorials/spce/ibi_pressure usr/share/votca/csg-tutorials/spce/ibi_pressure/CG-CG.dist.tgt usr/share/votca/csg-tutorials/spce/ibi_pressure/conf.gro usr/share/votca/csg-tutorials/spce/ibi_pressure/grompp.mdp usr/share/votca/csg-tutorials/spce/ibi_pressure/index.ndx usr/share/votca/csg-tutorials/spce/ibi_pressure/run.sh usr/share/votca/csg-tutorials/spce/ibi_pressure/settings.xml usr/share/votca/csg-tutorials/spce/ibi_pressure/table.xvg usr/share/votca/csg-tutorials/spce/ibi_pressure/topol.top usr/share/votca/csg-tutorials/spce/ibi_pressure_wjk usr/share/votca/csg-tutorials/spce/ibi_pressure_wjk/CG-CG.dist.tgt usr/share/votca/csg-tutorials/spce/ibi_pressure_wjk/conf.gro usr/share/votca/csg-tutorials/spce/ibi_pressure_wjk/grompp.mdp usr/share/votca/csg-tutorials/spce/ibi_pressure_wjk/index.ndx usr/share/votca/csg-tutorials/spce/ibi_pressure_wjk/run.sh usr/share/votca/csg-tutorials/spce/ibi_pressure_wjk/settings.xml usr/share/votca/csg-tutorials/spce/ibi_pressure_wjk/table.xvg usr/share/votca/csg-tutorials/spce/ibi_pressure_wjk/topol.top usr/share/votca/csg-tutorials/spce/imc usr/share/votca/csg-tutorials/spce/imc/CG-CG.dist.tgt usr/share/votca/csg-tutorials/spce/imc/conf.gro usr/share/votca/csg-tutorials/spce/imc/grompp.mdp usr/share/votca/csg-tutorials/spce/imc/index.ndx usr/share/votca/csg-tutorials/spce/imc/run.sh usr/share/votca/csg-tutorials/spce/imc/settings.xml usr/share/votca/csg-tutorials/spce/imc/table.xvg usr/share/votca/csg-tutorials/spce/imc/topol.top usr/share/votca/csg-tutorials/spce/re usr/share/votca/csg-tutorials/spce/re/CG-CG.dist.tgt usr/share/votca/csg-tutorials/spce/re/CG-CG.param.init 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