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gmso

Community

Flexible storage of chemical topology for molecular simulation.

Installation

To install this package, run one of the following:

Conda
$conda install conda-forge::gmso

Usage Tracking

0.16.2
0.16.1
0.16.0
0.15.0
0.14.0
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Downloads (Last 6 months): 0

Description

GMSO is designed to enable the flexible, general representation of chemical topologies for molecular simulation. Efforts are made to enable lossless, bias-free storage of data, without assuming particular chemistries, models, or using any particular engine's ecosystem as a starting point.

About

Summary

Flexible storage of chemical topology for molecular simulation.

Last Updated

Jun 9, 2026 at 15:11

License

MIT

Supported Platforms

noarch