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OpenFreeEnergy / gufe

grand unified free energy by OpenFE
https://gufe.readthedocs.io
MIT License
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RelativeHybridTopologyProtocolResult does not round trip through to_dict/from_dict #229

Closed richardjgowers closed 1 year ago

richardjgowers commented 1 year ago 
>>> tpr = openmm_rfe.RelativeHybridTopologyProtocolResult(...)
>>> tpr == tpr.from_dict(tpr.to_dict())
False