5 open source projects by openforcefield

The Open Forcefield Toolkit provides implementations of the SMIRNOFF format, parameterization engine, and other tools. Documentation available at http://open-forcefield-toolkit.readthedocs.io

Protein-Ligand Benchmark Dataset for Free Energy Calculations

Force fields produced by the Open Force Field Initiative

For discussing and aggregating data for force field development

Automated tools for submitting molecules to QCFractal