Emergent Order Parameters of Allostery: An AI Framework for Predicting and Engineering Protein Regulation

Integrates simulations, deep mutational scanning, and evolutionary data to quantify dynamic coupling in proteins. Develops allosteric order parameters and trains models predicting how mutations rewire long-range protein control mechanisms.

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Author Banu Ozkan
Last Updated September 10, 2026, 18:10 (UTC)
Published August 5, 2026, 18:10 (UTC)
Citation Banu Ozkan 2026. Emergent Order Parameters of Allostery: An AI Framework for Predicting and Engineering Protein Regulation. CyVerse Data Commons.
Description Integrates simulations, deep mutational scanning, and evolutionary data to quantify dynamic coupling in proteins. Develops allosteric order parameters and trains models predicting how mutations rewire long-range protein control mechanisms.
PublicationYear 2026
Publisher CyVerse Data Commons
Rights This material is based upon work supported by the U.S. National Science Foundation under Award No. #2335029. Any opinions, findings and conclusions or recommendations expressed in this material are those of the author(s) and do not necessarily reflect the views of the U.S. National Science Foundation.
Subject allostery, protein regulation, machine learning, molecular dynamics, allosteric order parameters, deep mutational scanning
de_created_date 2026-03-04T17:25:49Z
de_modified_date 2026-07-28T22:07:47Z