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mdanalysis

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A Python package for the handling and analysis of molecular simulations data.

Installation

To install this package, run one of the following:

Conda
$conda install conda-forge::mdanalysis

Usage Tracking

2.10.0
2.9.0
2.8.0
2.7.0
2.6.1
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Downloads (Last 6 months): 0

Description

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.

About

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

macOS-64
win-64
macOS-arm64
linux-ppc64le
linux-aarch64
linux-64