Open jeff231li opened 2 years ago
This PR updates the Evaluator-related modules as a result of changes by introducing openff-units.
openff-units
evaluator/setup.py
evaluator/analyze.py
restraints/read_yaml.py
unit.Quantity
Merging #183 (65e4735) into master (8655108) will increase coverage by 1.88%. The diff coverage is 74.08%.
1.88%
74.08%
codecov-commenter
commented
2 years ago codecov-commenter
commented
2 years ago
This PR updates the Evaluator-related modules as a result of changes by introducing
openff-units.evaluator/setup.py-- symmetry and wall restraint modulesevaluator/analyze.py-- symmetry correction and reference state workrestraints/read_yaml.py-- converts string in Taproom tounit.QuantityTODO