Sanketh Vedula (@sankethvedula.bsky.social)

📢 New preprint, lead by Alex Bronstein, @sankethvedula.bsky.social and colleagues: Guiding AlphaFold with experimental data. This approach generates conformational ensembles guided by NMR, X-ray (or whatever) data. I am thrilled to tackle lots of exciting problems with it! arxiv.org/abs/2502.09372

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Inverse problems with experiment-guided AlphaFold Proteins exist as a dynamic ensemble of multiple conformations, and these motions are often crucial for their functions. However, current structure prediction methods predominantly yield a single conf... https://arxiv.org/abs/2502.09372