BaiChen Group Index

Multi-Responsive Peptide-Based Ultrathin Nanosheetsprepared By A Horizontal Monolayer Assembly

Yanmei He, Xiaohong Zhu, Lei Wang, Yue Zhang, chen Bai, Dongdong wu

Angewandte Chemie e202405765

Exploring The Activation Mechanism Of Metabotropic Glutamate 5 Receptor 2

Xiaohong Zhu, Mengqi Luo, Ke AN , Danfeng Shi, Tingjun Hou* , Arieh Warshel* , Chen Bai

Proc. Natl. Acad. Sci. U.S.A. 121 (21) e2401079121

Guided Diffusion For Molecular Generation With Interaction Prompt

Peng Wu, Huabin Du, Yingchao Yan, Tzong-Yi Lee, Chen Bai, Song Wu

Briefings in Bioinformatics 2024, 25(3)

Mechanistic Study Of The Transmission Pattern Of The Sars-Cov-2 Omicron Variant

Ke An, Xianzhi Yang, Mengqi Luo, Junfang Yan, Peiyi Xu, Honghui Zhang, Yuqing Li, Song Wu, Arieh Warshel, Chen Bai

Proteins 2024; 1–15

Predicting Mutational Effects On Ca2+-Activated Chloride Conduction Of Tmem16a Based On A Simulation Study

Yue Zhang, Kang Wu, Yuqing Li, Song Wu*, Arieh Warshel*, Chen Bai*

J. Am. Chem. Soc. 2024, 146, 7, 4665–4679

Insights Into The Inhibitory Mechanisms Of The Covalent Drugs For Dnmt3a

Wei Yang, Jingyuan Zhuang, Chen Li, Chen Bai, Guijuan Cheng

I. J. Molecular Sciences 2023, 24(16), 12652

In Silico Optimization Of Sars-Cov-2 Spike Specific Nanobodies

Xiaohong Zhu, Ke An, Junfang Yan, Peiyi Xu, Chen Bai

Frontiers in Bioscience-Landmark 2023, 28(4), 67

Studies Of The Mechanism Of Nucleosome Dynamics: A Review On Multifactorial Regulation From Computational And Experimental Cases

Danfeng Shi,Yuxin Huang, Chen Bai

Polymers 2023, 15(7), 1763

Exploring The Phospholipid Transport Mechanism Of Atp8a1-Cdc50

Honghui Zhang, Yue Zhang, Peiyi Xu, Chen Bai

Biomedicines 2023, 11(2), 546

A Systematic Study On The Binding Affinity Of Sars-Cov-2 Spike Protein To Antibodies

Ke An, Xiaohong Zhu, Junfang Yan, Peiyi Xu, Linfeng Hu, Chen Bai

AIMS Microbiology 2022, 8(4): 595-611

The Nature Of Functional Features Of Different Classes Of G-Protein-Coupled Receptors

Ke An, Xiaohong Zhu, Chen Bai

Biology 2022,11,1839

Application Of Computational Biology And Artificial Intelligence In Drug Design

Yue Zhang, Mengqi Luo, Peng Wu, Song Wu, Tzong-Yi Lee, Chen Bai

International Journal of Molecular Sciences 2022,23,13568

Mechanism Study Of Proteins Under Membrane Environment

Yue Zhang, Xiaohong Zhu, Honghui Zhang, Junfang Yan, Peiyi Xu, Peng Wu, Song Wu, Chen Bai

Membranes 2022, 12, 7, 694

Activation And Allosteric Regulation Of The Orphan Gpr88-Gi1 Signaling Complex

Geng Chen, Jun Xu, Asuka Inoue, Maximilian F. Schmidt, Chen Bai, Qiuyuan Lu, Peter Gmeiner, Zheng Liu, Yang Du

Nature Communications 2022, 13, 2375

Application Of Coarse-Grained (Cg) Models To Explore Conformational Pathway Of Large-Scale Protein Machines

Danfeng Shi, Ke An, Honghui Zhang, Peiyi Xu, Chen Bai

Entropy 2022, 24(5), 620

Mirtarbase Update 2022: An Informative Resource For Experimentally Validated Mirna–Target Interactions

Hsi-Yuan Huang, Yang-Chi-Dung Lin, Shidong Cui, Yixian Huang, Yun Tang, Jiatong Xu, Jiayang Bao, Yulin Li, Jia Wen, Huali Zuo, Weijuan Wang, Jing Li, Jie Ni, Yini Ruan, Liping Li, Yidan Chen, Yueyang Xie, Zihao Zhu, Xiaoxuan Cai, Xinyi Chen, Lantian Yao, Yigang Chen, Yijun Luo, Shupeng LuXu, Mengqi Luo, Chih-Min Chiu, Kun Ma, Lizhe Zhu, Gui-Juan Cheng, Chen Bai, Ying-Chih Chiang, Liping Wang, Fengxiang Wei, Tzong-Yi Lee, Hsien-Da Huang

Nucleic Acids Research 2022, 7;50(D1), D222-D230

Predicting Mutational Effects On Receptor Binding Of The Spike Protein Of Sars-Cov‑2 Variants

Chen Bai, Junlin Wang, Geng Chen, Honghui Zhang, Ke An, Peiyi Xu, Yang Du, Richard D. Ye, Arjun Saha, Aoxuan Zhang, Arieh Warshel

J. Am. Chem. Soc. 2021,143,42,17646-17654

Exploring The Activation Process Of The Β2ar‑Gs Complex

Chen Bai, Junlin Wang, Dibyendu Mondal, Yang Du, Richard D. Ye, Arieh Warshel

J. Am. Chem. Soc. 2021,143,29,11044-11051

The Catalytic Dwell In Atpases Is Not Crucial For Movement Against Applied Torque

Chen Bai, Mojgan Asadi, Arieh Warshel

Nature Chemistry 2020,12,12,1187-1192

Critical Differences Between The Binding Features Of The Spike Proteins Of Sars-Cov-2 And Sars-Cov

Chen Bai, Arieh Warshel

J. Phys. Chem. B 2020, 124, 28, 5907-5912

Revisiting The Protomotive Vectorial Motion Of F 0-Atpase

Chen Bai, Arieh Warshel

Proc. Natl. Acad. Sci. U.S.A. 2019, 116, 39, 19484-19489

On The Control Of The Proton Current In The Voltage-Gated Proton Channel Hv1

Myungjin Lee, Chen Bai, Mikolaj Feliks, Raphael Alhadeff, Arieh Warshel

Proc. Natl. Acad. Sci. U.S.A. 2018, 115, 41, 10321-10326

Chemistry With Semi-Classical Electrons: Reaction Trajectories Auto-Generated By Sub-Atomistic Force Fields

Chen Bai, Seyit Kale, Judith Herzfeld

Chemical Science 2017,8,4203-4210

Special Pairs Are Decisive In The Autoionization And Recombination Of Water

Chen Bai, Judith Herzfeld

Journal of Physical Chemistry B 2017,121,16,4213-4219

Surface Propensities Of The Self-Ions Of Water

Chen Bai, Judith Herzfeld

ACS Central Science 2016,2,4,225-231

Molecular Dynamics Simulations Of Methanol-To-Olefin Reactions In Hzsm-5 Zeolite Using A Reaxff Force Field

Chen Bai, Lianchi Liu, Huai Sun

Journal of Physical Chemistry C 2012,116,12,7029-7039

Mechanism And Kinetics For The Initial Steps Of Pyrolysis And Combustion Of 1,6-Dicyclopropane-2,4-Hexyne From Reaxff Reactive Dynamics

Lianchi Liu, Chen Bai, Huai Sun, William A. Goddard, III

Journal of Physical Chemistry A 2011,115,19,4941-4950

Publications