Zhongyue John Yang

Affiliations: 
Vanderbilt University, Nashville, TN 
Area:
Computational Enzymology
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"Zhongyue Yang"
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Parents

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Heather Kulik grad student Vanderbilt
Kendall N. Houk grad student 2013-2017 UCLA

Children

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Matthew Tremblay research assistant 2020-2022 Vanderbilt
Qianzhen Shao grad student 2021-2026
Yaoyukun Jiang post-doc 2021-
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Publications

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Jiang Y, Ding N, Shao Q, et al. (2023) Substrate Positioning Dynamics Involves a Non-Electrostatic Component to Mediate Catalysis. The Journal of Physical Chemistry Letters. 14: 11480-11489
Ran X, Jiang Y, Shao Q, et al. (2023) EnzyKR: a chirality-aware deep learning model for predicting the outcomes of the hydrolase-catalyzed kinetic resolution. Chemical Science. 14: 12073-12082
Yang ZJ, Shao Q, Jiang Y, et al. (2023) Mutexa: A Computational Ecosystem for Intelligent Protein Engineering. Journal of Chemical Theory and Computation
Shao Q, Jiang Y, Yang ZJ. (2023) EnzyHTP Computational Directed Evolution with Adaptive Resource Allocation. Journal of Chemical Information and Modeling
Shin W, Ran X, Yang ZJ. (2023) Accelerated Entropic Path Sampling with a Bidirectional Generative Adversarial Network. The Journal of Physical Chemistry. B. 127: 4254-4260
Juarez RJ, Jiang Y, Tremblay M, et al. (2023) LassoHTP: A High-Throughput Computational Tool for Lasso Peptide Structure Construction and Modeling. Journal of Chemical Information and Modeling. 63: 522-530
Jiang Y, Stull SL, Shao Q, et al. (2022) Convergence in determining enzyme functional descriptors across Kemp eliminase variants. Electronic Structure (Bristol, England). 4
Jiang Y, Ran X, Yang ZJ. (2022) Data-Driven Enzyme Engineering to Identify Function-Enhancing Enzymes. Protein Engineering, Design & Selection : Peds
Fu B, Nazemi A, Levin BJ, et al. (2022) Mechanistic Studies of a Skatole-Forming Glycyl Radical Enzyme Suggest Reaction Initiation via Hydrogen Atom Transfer. Journal of the American Chemical Society. 144: 11110-11119
Yang Z, Hajlasz N, Kulik HJ. (2022) Computational Modeling of Conformer Stability in Benenodin-1, a Thermally Actuated Lasso Peptide Switch. The Journal of Physical Chemistry. B
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