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A batteries-included toolkit for the GPU-accelerated OpenMM molecular simulation engine.

copied from cf-staging / openmmtools

Installers

Info: This package contains files in non-standard labels.
  • noarch v0.24.0
  • linux-64 v0.20.0
  • osx-64 v0.20.0

conda install

To install this package run one of the following:
conda install conda-forge::openmmtools
conda install conda-forge/label/broken::openmmtools
conda install conda-forge/label/openmmtools_dev::openmmtools
conda install conda-forge/label/openmmtools_rc::openmmtools

Description

openmmtools is a Python library layer that sits on top of OpenMM to provide access to a variety of useful tools for building full-featured molecular simulation packages.


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