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Theoretical and Computational Chemistry

Working Paper

DenseCPD: Improving the Accuracy of Neural-Network-Based Computational Protein Sequence Design with DenseNet

Yifei Qi, John Z.H. Zhang

Version 1 posted 24 January 2020

769

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Catalysis

Working Paper

Interfacial connections between organic perovskite/n+ silicon/catalyst that allow integration of solar cell and catalyst for hydrogen evolution from water

Hengfei Gu, Fei Zhang, Shinjae Hwang, Anders B. Laursen, Xin Liu, So Yeon Park, Mengjin Yang, Rosemary C. Bramante, Hussein Hijazi, Leila Kasaei, Leonard C. Feldman, Yao-Wen Yeh, Philip E. Batson, Bryon W. Larson, Mengjun Li, Yifei Li, Kai Zhu, Eric Garfunkel, G. Charles Dismukes

Version 1 posted 12 August 2022

359

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Biological and Medicinal Chemistry

Working Paper

Identification of a Small Molecule that Binds to the PD-L1 Dimer Interface

Wei Xia, Hengwei Bian, Liping He, Suzhen Dong, Yifei Qi, John Z.H. Zhang

Version 1 posted 24 February 2023

275

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Biological and Medicinal Chemistry

Working Paper

PAM-expanded Streptococcus thermophilus Cas9 C-to-T and C-to-G base editors for programmable base editing in mycobacteria

Quanjiang Ji, Hongyuan Zhang, Yifei Zhang, Wei-Xiao Wang, Weizhong Chen, Xia Zhang, Xingxu Huang, Wei Chen

Version 1 posted 22 October 2021

440

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Catalysis

Working Paper

Dynamics of Ce-O bond energy upon formation of O vacancies

Xuze Guan, Zhangyi Yao, Hao-xin Liu, Yonghui Liu, Rong Han, Lu Chen, Deniz Wong, Christian Schulz, Hiroyuki Asakura, Jie Zhang, Shusaku Hayama, Matthijs A. van Spronsen, Yifei Ren, Lun Zhang, Xinlian Su, Tsunehiro Tanaka, Yuzheng Guo, Chun-jiang Jia, Feng Ryan Wang

Version 1 posted 08 September 2023

463

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Catalysis

Working Paper

Rate-Limiting Reaction of Dehydrogenative Dimerization of Ethanol to Ethyl Acetate and Hydrogen on Cu, Cu2, and Cu13 Clusters: Size Dependence

Kang Sun, Zhipeng Wu, Ruitao Wu, Yifei Chen, Minhua Zhang, Lichang Wang

Version 1 posted 25 January 2023

190

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Catalysis

Working Paper

Effects of Alloyed Metal of Cu3X(111) on Controlling O-H and α-C-H Bond Cleavages for Ethanol Dehydrogenation (X=Zr, In, Ag, Au)

Han Xu, Ruitao Wu, Minhua Zhang, Bei Miao, Yifei Chen, Lichang Wang

Version 1 posted 09 January 2023

154

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Theoretical and Computational Chemistry

Working Paper

On-the-Fly Nonadiabatic Dynamics of Caffeic Acid Sunscreen Compound

Xu Kang, Yifei Zhu, Juanjuan Zhang, Chao Xu, Zhenggang Lan

Version 1 posted 17 November 2022

142

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1

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Theoretical and Computational Chemistry

Working Paper

Robust Protein-Ligand Interaction Modeling Integrating Physical Laws and Geometric Knowledge for Absolute Binding Free Energy Calculation

Qun Su, Jike Wang, Qiaolin Gou, Renling Hu, Hui Zhang, Linlong Jiang, Tianyue Wang, Yifei Liu, Chao Shen, Yu Kang, Chang-Yu Hsieh, Tingjun Hou

Version 1 posted 15 November 2024

395

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Refine Search

9 results in Yifei Zhang in Authors: Yifei Zhang

DenseCPD: Improving the Accuracy of Neural-Network-Based Computational Protein Sequence Design with DenseNet

Interfacial connections between organic perovskite/n+ silicon/catalyst that allow integration of solar cell and catalyst for hydrogen evolution from water

Identification of a Small Molecule that Binds to the PD-L1 Dimer Interface

PAM-expanded Streptococcus thermophilus Cas9 C-to-T and C-to-G base editors for programmable base editing in mycobacteria

Dynamics of Ce-O bond energy upon formation of O vacancies

Rate-Limiting Reaction of Dehydrogenative Dimerization of Ethanol to Ethyl Acetate and Hydrogen on Cu, Cu2, and Cu13 Clusters: Size Dependence

Effects of Alloyed Metal of Cu3X(111) on Controlling O-H and α-C-H Bond Cleavages for Ethanol Dehydrogenation (X=Zr, In, Ag, Au)

On-the-Fly Nonadiabatic Dynamics of Caffeic Acid Sunscreen Compound

Robust Protein-Ligand Interaction Modeling Integrating Physical Laws and Geometric Knowledge for Absolute Binding Free Energy Calculation

9 results in Authors: Yifei Zhang