touchpoint_15 Feb 2024

Agenda

1. Housekeeping and review TODO (15 mins)
2. Review project board (30 mins)
3. Plan next week (15 mins)

Attendees

1. Mike
2. Stephen
3. Ankit
4. Cameron
5. Yilin
6. Steven
7. Amjad

Meeting notes

• Mike added the readthedocs compilation during merge into main branch. He is also planning to add in cookbooks (executable in google collab notebooks) and installation instructions to the readthedocs page.
• Mike is working on the cif reader and testing where the openFF code fails to detect molecules correctly
• Mike also looked into the problematic celery scheduler which makes it difficult to debug failed QM jobs. Mike is looking into adding the option of running it in series for ease of debugging

Action Items

1. Create a new user story for Bespoke FF integration with OpenFE workflow - Yilin, Kaushik