CORC

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CORC

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Discovery of novel inhibitors against main protease (Mpro) of SARS-CoV-2 via virtual screening and biochemical evaluation 期刊论文
BIOORGANIC CHEMISTRY, 2021, 卷号: 110, 页码: 8
作者:  Guo, Sheng;  Xie, Hang;  Lei, Yu;  Liu, Bin;  Zhang, Li
收藏  |  浏览/下载：34/0  |  提交时间：2021/08/17
Ligand-based approach for predicting drug targets and for virtual screening against COVID-19 期刊论文
BRIEFINGS IN BIOINFORMATICS, 2021, 卷号: 22, 期号: 2, 页码: 1053-1064
作者:  Yang, Yanqing;  Zhu, Zhengdan;  Wang, Xiaoyu;  Zhang, Xinben;  Mu, Kaijie
收藏  |  浏览/下载：26/0  |  提交时间：2021/11/16
Identify potent SARS-CoV-2 main protease inhibitors via accelerated free energy perturbation-based virtual screening of existing drugs 期刊论文
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, 2020, 卷号: 117, 期号: 44, 页码: 27381-27387
作者:  Li, Zhe;  Li, Xin;  Huang, Yi-You;  Wu, Yaoxing;  Liu, Runduo
收藏  |  浏览/下载：75/0  |  提交时间：2020/12/24
Structure of SARS-CoV-2 main protease in the apo state 期刊论文
SCIENCE CHINA-LIFE SCIENCES, 2020, 页码: 4
作者:  Zhou, Xuelan;  Zhong, Fanglin;  Lin, Cheng;  Hu, Xiaohui;  Zhang, Yan
收藏  |  浏览/下载：14/0  |  提交时间：2020/12/24
Structure-based design of antiviral drug candidates targeting the SARS-CoV-2 main protease 期刊论文
SCIENCE, 2020, 卷号: 368, 期号: 6497, 页码: 1331-+
作者:  Dai, Wenhao;  Zhang, Bing;  Jiang, Xia-Ming;  Su, Haixia;  Li, Jian
收藏  |  浏览/下载：30/0  |  提交时间：2020/12/24
alpha-Ketoamides as Broad-Spectrum Inhibitors of Coronavirus and Enterovirus Replication: Structure-Based Design, Synthesis, and Activity Assessment 期刊论文
JOURNAL OF MEDICINAL CHEMISTRY, 2020, 卷号: 63, 期号: 9, 页码: 4562-4578
作者:  Zhang, Linlin;  Lin, Daizong;  Kusov, Yuri;  Nian, Yong;  Ma, Qingjun
收藏  |  浏览/下载：31/0  |  提交时间：2020/07/01
Structure of M-pro from SARS-CoV-2 and discovery of its inhibitors 期刊论文
NATURE, 2020, 页码: 24
作者:  Jin, Zhenming;  Du, Xiaoyu;  Xu, Yechun;  Deng, Yongqiang;  Liu, Meiqin
收藏  |  浏览/下载：41/0  |  提交时间：2020/07/01
Comparative QSAR studies using HQSAR, CoMFA, and CoMSIA methods on cyclic sulfone hydroxyethylamines as BACE1 inhibitors 期刊论文
COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2017, 卷号: 67, 页码: 38-47
作者:  Zhang, Shuqun;  Lin, Zichun;  Pu, Yinglan;  Zhang, Yunqin;  Zhang, Li
收藏  |  浏览/下载：25/0  |  提交时间：2019/01/08
BACE1  AD  HQSAR  CoMFA  CoMSIA  
Probing Origin of Binding Difference of inhibitors to MDM2 and MDMX by Polarizable Molecular Dynamics Simulation and QM/MM-GBSA Calculation 期刊论文
SCIENTIFIC REPORTS, 2015, 卷号: 5
作者:  Chen, Jianzhong;  Wang, Jinan;  Zhang, Qinggang;  Chen, Kaixian;  Zhu, Weiliang
收藏  |  浏览/下载：19/0  |  提交时间：2019/01/08
Non-Covalent Interactions with Aromatic Rings: Current Understanding and Implications for Rational Drug Design 期刊论文
CURRENT PHARMACEUTICAL DESIGN, 2013, 卷号: 19, 期号: 36, 页码: 6522-6533
作者:  Li, Shanshan;  Xu, Yuan;  Shen, Qiancheng;  Liu, Xian;  Lu, Jing
收藏  |  浏览/下载：20/0  |  提交时间：2019/01/08

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