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Flexible storage of chemical topology for molecular simulation.

copied from cf-post-staging / gmso

Installers

  • noarch v0.14.0

conda install

To install this package run one of the following:
conda install conda-forge::gmso

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.


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