To get started using OpenFF tools and force fields, go to https://docs.openforcefield.org
For information about the Open Force Field Consortium and Initiative, see https://openforcefield.org
For general questions and high-level discussions, please chime in at https://github.com/orgs/openforcefield/discussions
Input files and scripts for benchmarking OpenFF force fields with yammbs
Automated tools for the generation of bespoke SMIRNOFF format parameters for individual molecules.
The Open Forcefield Toolkit provides implementations of the SMIRNOFF format, parameterization engine, and other tools. Documentation available at http://open-forcefield-toolkit.readthedocs.io
A project (and object) for storing, manipulating, and converting molecular mechanics data.