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MobleyLab / blues

Applications of nonequilibrium candidate Monte Carlo (NCMC) to ligand binding mode sampling
https://mobleylab-blues.readthedocs.io/en/latest
MIT License
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Add water Translational Moves #166

Closed sgill2 closed 4 years ago

sgill2 commented 4 years ago

Description

Adds water translational moves to the BLUES move pool

Todos

Notable points that this PR has either accomplished or will accomplish.

Status

bergazin commented 4 years ago

Looks good!

sgill2 commented 4 years ago

Tests are passing locally so I'm going ahead and merging this.