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openmm

Community

A high performance toolkit for molecular simulation.

Installation

To install this package, run one of the following:

Conda
$conda install conda-forge::openmm

Usage Tracking

8.5.1rc1
8.5.0
8.5.0rc1
8.5.0beta
8.4.0
5 / 8 versions selected
Downloads (Last 6 months): 0

Description

OpenMM is a toolkit for molecular simulation. It can be used either as a stand-alone application for running simulations, or as a library you call from your own code. It provides a combination of extreme flexibility (through custom forces and integrators), openness, and high performance (especially on recent GPUs) that make it truly unique among simulation codes. OpenMM is MIT licensed with some LGPL portions (CUDA and OpenCL platforms).

About

Summary

A high performance toolkit for molecular simulation.

Last Updated

Mar 20, 2026 at 19:22

License

LGPL-3.0-or-later

Total Downloads

4.0M

Version Downloads

22.2K

Supported Platforms

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

Unsupported Platforms

linux-ppc64le Last supported version: 7.6.0