chemical-environment-perception

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openforcefield / openff-toolkit
The Open Forcefield Toolkit provides implementations of the SMIRNOFF format, parameterization engine, and other tools. Documentation available at http://open-forcefield-toolkit.readthedocs.io
molecular-dynamics force-fields openmm amber chemical-environment-perception smirnoff-force-field molecular-mechanics nsf-grant-che-1738979 open-force-field-consortium forcefield forcefield-parameterization
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