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.
Need Help? Check out the documentation and discussion forums.
- Travis CI
linuxandosxintegration tests:- GitHub master
openmm-devrecipe
- GitHub master
- Anaconda Cloud
openmmconda release: - Anaconda Cloud
openmm-devconda package:
