pypi.org "charmm" keyword
pytim 1.0.9
Python Tool for Interfacial Molecules Analysis28 versions - Latest release: 4 months ago - 1 dependent repositories - 146 downloads last month - 98 stars on GitHub - 1 maintainer
polyply 1.8.0
Generate input parameters and coordinates for atomistic and coarse-grained simulations of polymer...14 versions - Latest release: about 1 year ago - 1 dependent repositories - 445 downloads last month - 203 stars on GitHub - 1 maintainer
pyadmd 3.4.0
Adaptive Molecular Dynamics with Excited Normal Modes (aMDeNM) on OpenMM.8 versions - Latest release: about 1 month ago - 270 downloads last month - 0 stars on GitHub - 1 maintainer
Top 8.3% on pypi.org
15 versions - Latest release: 29 days ago - 2 dependent packages - 1 dependent repositories - 2.88 thousand downloads last month - 264 stars on GitHub - 2 maintainers
acpype 2026.10.8 💰
ACPYPE - AnteChamber PYthon Parser interfacE15 versions - Latest release: 29 days ago - 2 dependent packages - 1 dependent repositories - 2.88 thousand downloads last month - 264 stars on GitHub - 2 maintainers
longbow 1.5.5
Biomolecular simulation remote job submission tool.21 versions - Latest release: 4 months ago - 1 dependent repositories - 855 downloads last month - 18 stars on GitHub - 1 maintainer
cgen2gmx 1.1.0
A small commandline tool for managing forcefield parameters used in molecular dynamics simulations4 versions - Latest release: about 2 years ago - 10 downloads last month - 3 stars on GitHub - 1 maintainer
mmpbsa-analysis-software 1.0
MMPBSA Analysis Software using GROMACS and APBS1 version - Latest release: over 2 years ago - 20 downloads last month - 1 maintainer
Related Keywords
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2
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1
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1
interfaces
1
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1
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simulations
1
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computational chemistry
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1
normal-modes
1
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1
molecular-modeling
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1
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python3
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xplor
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normal modes
1
aMDeNM
1
OpenMM
1
enhanced sampling
1
elastic-network-models
1
enhanced-sampling
1
enm
1
molecular-dynamics-simulation
1