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MDAnalysis/mdanalysis

MDAnalysis is a Python library to analyze molecular dynamics simulations.

computational-chemistrymdanalysismolecular-dynamicsmolecular-dynamics-simulationmolecular-simulationpythonsciencetrajectory-analysis

License & maintenance

Custom or modified license that GitHub does not recognise: read the LICENSE file in the repository before using it in a product.

Last code push 4 days ago.