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

Version 1 Current »

Participants

Discussion topics

Item

Notes

General updates

  • JW – Made QCSubmit release. I’m 85ish% certain it’s not critically broken, though it may need patches/tweaks if weird behavior is found. The fitting team is meeting DD next Tuesday afternoon to try getting qca-dataset-submission running again and submitting calcs.

  • JW – I’ll be offline until Nov 29

    • Will be without a laptop, but will have Slack access for next ~week.

    • Cancel meetings

  • Priorities while I’m out:

    • Coordinate with Joshs to get issues triaged

    • Keep advancing on internal benchmarking

    • Make builds/releases of all packages as needed to keep deployment green

    • Feel free to make releases of all packages without major API/behavior changes.

    • Direct managerial/org questions to DM or JE, and do what they say

    • Feel free to attend alchemiscale meetings to learn what’s going on, but you will NOT be responsible for the OpenFF approver vote.

    • Touch base with JMitchell once or twice a week. He will have his own to-do list but feel free to loop him in for reviews or small tasks.

    • Coordinate updating qca-dataset-submission to use new QCSubmit with DDotson (this will require removing downpins on QC* that prevent installing with >=0.50). THEN update bespokefit and internal benchmarking to use new qcsubmit.

    • (new) Help OpenFE with Interchange adoption once they ask.

Trello

Action items

  •  

Decisions

  • No labels