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Participants
Discussion topics
Item | Notes |
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General updates | |
Todos
| (high) Resolve feedback on BespokeFit PR and make discussed change (medium) Prepare material for Bespokefit workshop (materials from last time) (medium) Update bespokefit to work with Toolkit 0.11.0 (medium) Centralized examples (from) (high) bespokefit protein-ligand or ligand-in-water example
(medium) Centralized OpenFF “book” docs (medium) Toolkit docs cleanup (medium) Toolkit revised user guide (+-unifying/centralizing package user guides) (medium) Come up with “milestones” for making first of three videos this year (like, “first video on covid spike protein and small molecule, filmed this day, edited in that range, etc…”) (medium) bibtex blocks for website “how to cite” page on (low) Propose policy for using GH citation machinery (low) Check main website for broken links (low) Conda env yamls for each release (automated inside of Toolkit’s single-file-installer action)
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