/tools/openff-fragmenter
openff-fragmenter
openforcefield/openff-fragmenter
summary
The openff-fragmenter is a Python package designed to fragment molecules for quantum mechanics torsion scans. It allows users to visualize and manipulate molecular fragments, making it a useful tool in molecular design and computational chemistry.
description
Fragment molecules for quantum mechanics torsion scans
topics
nsf-grant-che-1738979forcefieldforce-fieldforcefield-parameterization
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