mdanalysis
A Python package for the handling and analysis of molecular simulations data.
A Python package for the handling and analysis of molecular simulations data.
To install this package, run one of the following:
MDAnalysis is a Python library to analyze trajectories from molecular dynamics (MD) simulations. It can read and write most popular formats, and provides a flexible and fast framework for writing custom analysis through making the underlying data easily available as NumPy arrays.
Summary
A Python package for the handling and analysis of molecular simulations data.
Last Updated
Oct 18, 2025 at 12:57
License
LGPL-3.0-or-later
Total Downloads
1.0M
Supported Platforms
GitHub Repository
https://github.com/MDAnalysis/mdanalysisDocumentation
https://docs.mdanalysis.org/