choderalab/perses: Release 0.9.0
- Patrick Grinaway
- John Chodera
- Hannah Bruce Macdonald
- dominicrufa
- Julie M Behr
- zhang-ivy
- Jaime Rodríguez-Guerra
- Matt Wittmann
- Mike Henry
- William Glass
- Steven Albanese
- Ana Silveira
- Levi Naden
Publication date
May 2021
DOIAbstract
CI improvements: PR #736 #739 #751 #761 #763 Refactoring: PR #768 #773 #775 #786 Bug Fixes: PR #744 #745 #746 #783 Enhancements: Deterministic Geometry Proposa Enable hybrid topology factory to be repartitioned at the endstates Add option to impose RMSD restraint on core heavy atoms and nearby protein CA atom
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