General updates | JW – LW is starting org-level discussions repo. I think this is a really good thing. Expect email spam for a bit, though. JW – I think Venkata’s solution on the GH issue is roughly suitable to be our “final FB fix”. I’ll spend maybe one more hour on this today and then open a PR for review. In openff-forcebalance I anticipate that a lot of it will be wholly removed and replaced with interchange. MT – Agree. FB architecture is kinda wonky and I’m not going to fundamentally change it initially. But eventually I’d like to get to replacing that. MT – Building up a good test base, once that’s more complete I’ll be more comfortable making structural changes.
JW – Lead team formally approved up to $1k for a GPU. If there’s trouble getting that we’re open to getting cloud compute, or priority time on the GPU queue at UCI.
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