K
Kaixian Chen
Researcher at Chinese Academy of Sciences
Publications - 403
Citations - 11476
Kaixian Chen is an academic researcher from Chinese Academy of Sciences. The author has contributed to research in topics: Virtual screening & Chemistry. The author has an hindex of 47, co-authored 380 publications receiving 9209 citations. Previous affiliations of Kaixian Chen include Shanghai University & East China University of Science and Technology.
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Artificial intelligence in drug design.
Feisheng Zhong,Jing Xing,Xutong Li,Xiaohong Liu,Xiaohong Liu,Zunyun Fu,Zhaoping Xiong,Zhaoping Xiong,Dong Lu,Xiaolong Wu,Jihui Zhao,Xiaoqin Tan,Fei Li,Fei Li,Xiaomin Luo,Zhaojun Li,Kaixian Chen,Kaixian Chen,Mingyue Zheng,Hualiang Jiang,Hualiang Jiang +20 more
TL;DR: Recently, due to the strong generalization ability and powerful feature extraction capability, deep learning methods have been employed in predicting the molecular properties as well as generating the desired molecules, which will further promote the application of AI technologies in the field of drug design.
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Rapid and efficient Pd-catalyzed sonogashira coupling of aryl chlorides
TL;DR: An efficient and effective microwave-assisted cross-coupling of terminal alkynes with various aryl chlorides including sterically hindered, electron-rich, electrons-neutral, and electron-deficient aryal chloride is developed.
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Nucleocapsid Protein of SARS Coronavirus Tightly Binds to Human Cyclophilin A
Cheng Luo,Haibin Luo,Suxin Zheng,Chunshan Gui,Liduo Yue,Changying Yu,Tao Sun,Pei-Lan He,Jing Chen,Jianhua Shen,Xiaomin Luo,Yixue Li,Hong Liu,Donglu Bai,Jingkang Shen,Yiming Yang,Fangqiu Li,Jianping Zuo,Rolf Hilgenfeld,Gang Pei,Kaixian Chen,Xu Shen,Hualiang Jiang +22 more
TL;DR: The presently observed SARS_NP–hCypA interaction model might provide a new hint for facilitating the understanding of another possible SARS-CoV infection pathway against human cell.
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Utilization of Halogen Bond in Lead Optimization: A Case Study of Rational Design of Potent Phosphodiesterase Type 5 (PDE5) Inhibitors
Zhijian Xu,Zheng Liu,Tong Chen,Tiantian Chen,Zhen Wang,Guanghui Tian,Jing Shi,Xuelan Wang,Yunxiang Lu,Xiuhua Yan,Guan Wang,Hualiang Jiang,Kaixian Chen,Shudong Wang,Yechun Xu,Jingshan Shen,Weiliang Zhu +16 more
TL;DR: X-ray crystal structures verified the existence of the predicted halogen bonds, demonstrating that the halogen bond is an applicable tool in drug design and should be routinely considered in lead optimization.
Journal ArticleDOI
Severe acute respiratory syndrome coronavirus 3C-like proteinase N terminus is indispensable for proteolytic activity but not for enzyme dimerization. Biochemical and thermodynamic investigation in conjunction with molecular dynamics simulations.
Shuai Chen,Lili Chen,Jinzhi Tan,Jing Chen,Li Du,Tao Sun,Jianhua Shen,Kaixian Chen,Hualiang Jiang,Xu Shen +9 more
TL;DR: The results suggest the N terminus is not indispensable for the proteinase dimerization but may fix the dimer at the active state and is therefore vital to enzymatic activity.