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Works (15)

SubTuner: a Physics-Guided Computational Tool for Modifying Enzymatic Substrate Preference and Its Application to Anion Methyltransferases

2024-10-30 | Preprint
DOI: 10.26434/chemrxiv-2024-zs8h9-v2
Contributors: Qianzhen Shao; Asher C. Hollenbeak; Yaoyukun Jiang; Xinchun Ran; Brian O. Bachmann; Zhongyue J. Yang
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Crossref

SubTuner: a Physics-Guided Computational Tool for Modifying Enzymatic Substrate Preference and Its Application to Anion Methyltransferases

2024-09-06 | Preprint
DOI: 10.26434/chemrxiv-2024-zs8h9
Contributors: Qianzhen Shao; Asher C. Hollenbeak; Yaoyukun Jiang; Brian O. Bachmann; Zhongyue J. Yang
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Crossref

EnzyKR: a chirality-aware deep learning model for predicting the outcomes of the hydrolase-catalyzed kinetic resolution

Chemical Science
2023 | Journal article
DOI: 10.1039/D3SC02752J
Contributors: Xinchun Ran; Yaoyukun Jiang; Qianzhen Shao; Zhongyue J. Yang
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Crossref

Substrate Positioning Dynamics Involves a Non-Electrostatic Component to Mediate Catalysis

The Journal of Physical Chemistry Letters
2023-12-21 | Journal article
DOI: 10.1021/acs.jpclett.3c02444
Contributors: Yaoyukun Jiang; Ning Ding; Qianzhen Shao; Sebastian L. Stull; Zihao Cheng; Zhongyue J. Yang
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Crossref

Mutexa: A Computational Ecosystem for Intelligent Protein Engineering

Journal of Chemical Theory and Computation
2023-11-14 | Journal article
DOI: 10.1021/acs.jctc.3c00602
Contributors: Zhongyue J. Yang; Qianzhen Shao; Yaoyukun Jiang; Christopher Jurich; Xinchun Ran; Reecan J. Juarez; Bailu Yan; Sebastian L. Stull; Anvita Gollu; Ning Ding
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Crossref

EnzyHTP Computational Directed Evolution with Adaptive Resource Allocation

Journal of Chemical Information and Modeling
2023-09-11 | Journal article
DOI: 10.1021/acs.jcim.3c00618
Contributors: Qianzhen Shao; Yaoyukun Jiang; Zhongyue J. Yang
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Crossref

Highly selective synthesis of all-carbon tetrasubstituted alkenes by deoxygenative alkenylation of carboxylic acids

Nature Communications
2022-12 | Journal article
DOI: 10.1038/s41467-021-27507-x
Part of ISSN: 2041-1723
Source: Self-asserted source
Qianzhen Shao

Metal‐Free C‐H Functionalization via Diaryliodonium Salts with a Chemically Robust Dummy Ligand

Angewandte Chemie International Edition
2022-05-03 | Journal article
DOI: 10.1002/anie.202201240
Part of ISSN: 1433-7851
Part of ISSN: 1521-3773
Source: Self-asserted source
Qianzhen Shao

EnzyHTP: A High-Throughput Computational Platform for Enzyme Modeling

Journal of Chemical Information and Modeling
2022-02-14 | Journal article
DOI: 10.1021/acs.jcim.1c01424
Part of ISSN: 1549-9596
Part of ISSN: 1549-960X
Source: Self-asserted source
Qianzhen Shao

High Site Selectivity in Electrophilic Aromatic Substitutions: Mechanism of C–H Thianthrenation

Journal of the American Chemical Society
2021-10-06 | Journal article
DOI: 10.1021/jacs.1c06281
Part of ISSN: 0002-7863
Part of ISSN: 1520-5126
Source: Self-asserted source
Qianzhen Shao

Rate-Perturbing Single Amino Acid Mutation for Hydrolases: A Statistical Profiling

The Journal of Physical Chemistry B
2021-09-15 | Journal article
DOI: 10.1021/acs.jpcb.1c05901
Part of ISSN: 1520-6106
Part of ISSN: 1520-5207
Source: Self-asserted source
Qianzhen Shao

Catalytic enantioselective synthesis of chiral tetraarylmethanes

Nature Catalysis
2020-12-14 | Journal article
DOI: 10.1038/s41929-020-00535-4
Contributors: Xingguang Li; Meng Duan; Zhiqin Deng; Qianzhen Shao; Min Chen; Guangyu Zhu; K. N. Houk; Jianwei Sun
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Crossref

Development of α,α-Disubstituted Crotylboronate Reagents and Stereoselective Crotylation via Brønsted or Lewis Acid Catalysis

Journal of the American Chemical Society
2020-10-28 | Journal article
DOI: 10.1021/jacs.0c04107
Part of ISSN: 0002-7863
Part of ISSN: 1520-5126
Source: Self-asserted source
Qianzhen Shao

Intercepting fleeting cyclic allenes with asymmetric nickel catalysis

Nature
2020-10-08 | Journal article
DOI: 10.1038/s41586-020-2701-2
Contributors: Michael M. Yamano; Andrew V. Kelleghan; Qianzhen Shao; Maude Giroud; Bryan J. Simmons; Bo Li; Shuming Chen; K. N. Houk; Neil K. Garg
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Crossref

Bioinspired Synthesis of (−)‐PF‐1018

Angewandte Chemie International Edition
2020-03-23 | Journal article
DOI: 10.1002/anie.201912452
Part of ISSN: 1433-7851
Part of ISSN: 1521-3773
Source: Self-asserted source
Qianzhen Shao

Peer review (1 review for 1 publication/grant)

Review activity for Nature communications (1)
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