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Participants

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Item

Presenter

Notes

General updates

  • JW –

    • Openff-utilities micromamba incompatibility - Expect a release tomorrow

    • ToolkitAM1BCC tag with AT/RDK backend will likely switch to specify ELF1 and some antechamber settings to improve consistency and quality (see all hands)

    • Thanks for BSwope help, messaging is kinda chaotic with him but his feedback is great.

Trello

Todos


  1. (high) Review+merge Topology loading cookbook PR

  2. (high) Add NaglToolkitWrapper to OpenFF Toolkit docs

  3. (due Dec 13 check in) Propose 3 workshops for Dec-Feb, including topic and format. (JW needs to report to ad board about this in Dec)(high) CZI full application (due Dec 5)

  4. (medium) RNA (openmmforcefields) + small mol/lipid (Sage) example (nucleic acid formulations are a hot topic, could get us funding/users) (details here)


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