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conda-forge.org : py-plumed
PLUMED is an open source library for free energy calculations in molecular systems which works together with some of the most popular molecular dynamics engines.
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purl: pkg:conda/py-plumed
Keywords: c-plus-plus, enhanced-sampling, free-energy, molecular-dynamics, plugin, plumed, plumed2, trajectory-analysis
License: LGPL-3.0
Latest release: over 1 year ago
First release: about 5 years ago
Dependent repositories: 1
Stars: 276 on GitHub
Forks: 239 on GitHub
See more repository details: repos.ecosyste.ms
Last synced: 15 days ago