2022-02-23 Mitchell/Wagner Check-in meeting notes

Updates

Todos

1. Feb 23 TODO FOR JEFF: Follow up on COOH conformer PR (approve if no feedback)

2. (high) QCSubmit users guide (in progress)

3. (high) ELF10 COOH conformer rotation issue (in progress)

4. (medium) Toolkit API desire paths

5. (medium) Toolkit docs cleanup

6. (medium) Toolkit revised user guide

7. (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…”)

8. (low) “How to cite” section on website (do not start, pending feedback)

9. (low) Check main website for broken links

10. (low) migrate docs to be under http://openforcefield.org

11. domain (openforcefield/status would be base project repo)

12. (low) Conda env yamls for each release (automated inside of Toolkit’s single-file-installer action)