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py311-MDAnalysis

2.7.0_2science

Python library to analyze molecular dynamics trajectories

MDAnalysis is an object-oriented Python library to analyze trajectories from molecular dynamics (MD) simulations in many popular formats. It can write most of these formats, too, together with atom selections suitable for visualization or native analysis tools.

$pkg install py311-MDAnalysis

www.mdanalysis.org ↗

Origin

science/py-MDAnalysis

Size

23.6MiB

License

GPLv2

Maintainer

yuri@FreeBSD.org

Dependencies

16 packages

Required by

1 packages

Dependencies (16)

rdkit python311 py311-tqdm py311-six py311-seaborn py311-scipy py311-numpy py311-networkx py311-mmtf-python py311-matplotlib py311-joblib py311-gsd py311-fasteners py311-biopython py311-GridDataFormats clustalw

Required By (1)

py311-MDAnalysisTests