John Gardner
@jla-gardner.bsky.social
📤 1818
📥 251
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ML for Potential Energy Surfaces PhD student at Oxford Former Microsoft AI4Science Intern
reposted by
John Gardner
Volker Deringer
6 months ago
Read more about our MLIP distillation preprint in John’s thread! 🙂
#compchem
#chemsky
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Excited to share the pre-print we’ve been working on for the last ~4 months: “Distillation of atomistic foundation models across architectures and chemical domains” Deep dive thread below! 🤿🧵
6 months ago
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I've been working hard behind the scenes, and am excited to announce that graph-pes version 0.1.0 is now out!
add a skeleton here at some point
8 months ago
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🚨 Introducing graph-pes: a unified framework for building, training and using graph-based machine-learned models of potential energy surfaces! 🚨
#compchem
#ML
#ChemSky
#CompChemSky
12 months ago
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Today I woke up to this 😮 a very small milestone, but also a very big one ☺️ more papers incoming soon!
about 1 year ago
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