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Item | Notes |
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General updates | |
Individual updates | JW Coordinating with AMBER devs re: vsites Came up with rough estimates for CPU+GPU total usage for OpenFF. KCJ will reference these numbers when companies offer partnerships or donations of compute resources. Some PR and issue clearance - Thanks SB for the CSP stereo thing in RDKit. I think EP0005b is ready? Unclear state, need to push again this week.
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