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OpenFreeEnergy
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pontibus
Experimental OpenFE Protocols for Force Field Evaluation
MIT License
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Merge `develop` branch into `main`
#1
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IAlibay
closed
1 month ago
IAlibay
commented
1 month ago
Alpha code merge.
Take-aways:
Pontibus now "works" in a limited capacity.
There will be developer API changes, but the top level user experience is unlikely to change.
There are some known issues which need to be debugged.
Alpha code merge.
Take-aways: