openff-bespokefit
Automated tools for the generation of bespoke SMIRNOFF format parameters for individual molecules.
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About
Summary
Automated tools for the generation of bespoke SMIRNOFF format parameters for individual molecules.
Last Updated
May 15, 2025 at 19:31
License
MIT
Total Downloads
0
GitHub Repository
https://github.com/openforcefield/openff-bespokefit