Skip to end of metadata
Go to start of metadata

You are viewing an old version of this page. View the current version.

Compare with Current View Page History

« Previous Version 3 Next »

\uD83D\uDDD3 Date

\uD83D\uDC65 Participants

\uD83D\uDDE3 Discussion topics

Item

Notes

Updates from MolSSI

Infrastructure advances


Throughput status

  • OpenFF Protein Capped 3-mer Backbones v1.0

    • Opts: 293477 → 299557 → 310894

    • TDs: 16 → 19 → 20

  • New submission from Ken Takabo, may need to add them to qca-dataset-submission repo

User questions/issues

DD: Added machine learning tag to SPICE sets but it seems to break the ML archive section of qca website. Need to discuss.

Science needs

✅ Action items

  •  

⤴ Decisions

  • No labels