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MDAnalysis

MDAnalysis is an object-oriented Python library to analyze trajectories from molecular dynamics (MD) simulations in many popular formats.

homepage: https://www.mdanalysis.org/

version versionsuffix toolchain
0.20.1 -Python-3.7.4 foss/2019b
0.20.1 -Python-3.7.4 intel/2019b
1.1.1 foss/2020b
2.0.0 foss/2021a
2.0.0 foss/2021b
2.0.0 intel/2021b
2.2.0 foss/2022a
2.4.2 foss/2021a
2.4.2 foss/2022b
2.7.0 foss/2023a

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