Yaoyukun Jiang, Ph.D.

Affiliations: 
2021- Chemistry Vanderbilt University, Nashville, TN 
Area:
Computational Chemistry; Enzymology; Spectroscopy
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"Yaoyukun Jiang"
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Parents

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Lu Wang grad student 2016-2021
Zhongyue John Yang post-doc 2021-
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Publications

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Long T, Li D, Vale G, et al. (2024) Molecular insights into human phosphatidylserine synthase 1 reveal its inhibition promotes LDL uptake. Cell
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
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
Jiang Y, Yan B, Chen Y, et al. (2022) Molecular Dynamics-Derived Descriptor Informs the Impact of Mutation on the Catalytic Turnover Number in Lactonase Across Substrates. The Journal of Physical Chemistry. B. 126: 2486-2495
Shao Q, Jiang Y, Yang ZJ. (2022) EnzyHTP: A High-Throughput Computational Platform for Enzyme Modeling. Journal of Chemical Information and Modeling. 62: 647-655
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