BiophysicsJournal of Chemical Information and ModelingPeer-reviewed
Sampling Conformational Ensembles of Highly Dynamic Proteins via Generative Deep Learning
Talant Ruzmetov, T. I. Hung, Saisri Padmaja Jonnalagedda…·Chia‐en A. Chang
This paper introduces a deep learning model to sample conformational ensembles of dynamic proteins, demonstrating its ability to generate novel conformations and rationalize experimental findings.
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