Michael Brocidiacono
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brocidiacono.bsky.social
Michael Brocidiacono
@brocidiacono.bsky.social
I teach chemistry to computers
Exciting to announce our latest paper on Ligand Force-Matching! Rapidly predicting how well a small molecule will bind to a protein is the bottleneck in virtual screening. ML methods can work well on targets similar to their training set, but often fail to generalize. (1/)
June 4, 2025 at 7:01 PM