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Allosteric Modulators Enhancing GLP-1 Binding to GLP-1R via a Transmembrane Site 期刊论文
ACS CHEMICAL BIOLOGY, 2021, 卷号: 16, 期号: 11, 页码: 2444-2452
作者:  Wang, Jiang;  Yang, Dehua;  Cheng, Xi;  Yang, Linlin;  Wang, Zhaohui
收藏  |  浏览/下载:27/0  |  提交时间:2022/01/04
Activation pathway of a G protein-coupled receptor uncovers conformational intermediates as targets for allosteric drug design 期刊论文
NATURE COMMUNICATIONS, 2021, 卷号: 12, 期号: 1, 页码: 15
作者:  Lu, Shaoyong;  He, Xinheng;  Yang, Zhao;  Chai, Zongtao;  Zhou, Shuhua
收藏  |  浏览/下载:36/0  |  提交时间:2021/11/04
Unveiling conformational dynamics changes of H-Ras induced by mutations based on accelerated molecular dynamics 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2020, 卷号: 22, 期号: 37, 页码: 21238-21250
作者:  Chen, Jianzhong;  Wang, Wei;  Pang, Laixue;  Zhu, Weiliang
收藏  |  浏览/下载:27/0  |  提交时间:2020/12/21
Molecular dynamics simulations reveal the mechanism of the interactions between the inhibitors and SIRT2 at atom level 期刊论文
MOLECULAR SIMULATION, 2020, 卷号: 46, 期号: 8, 页码: 638-649
作者:  Wang, Xiaoyu;  Song, Menghua;  Zhao, Shuang;  Li, Huiyu;  Zhao, Qingjie
收藏  |  浏览/下载:35/0  |  提交时间:2020/07/01
Full-length human GLP-1 receptor structure without orthosteric ligands 期刊论文
naturecommunications, 2020, 卷号: 11, 期号: 1, 页码: 1
作者:  Fan Wu;  Linlin Yang;  Kaini Hang;  Mette Laursen;  Lijie Wu
收藏  |  浏览/下载:27/0  |  提交时间:2020/07/01
Exploring the Ligand Binding/Unbinding Pathway by Selectively Enhanced Sampling of Ligand in a Protein-Ligand Complex 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2019, 卷号: 123, 期号: 38, 页码: 7974-7983
作者:  Shao, Qiang;  Zhu, Weiliang
收藏  |  浏览/下载:2/0  |  提交时间:2020/07/01
Identification of new NIK inhibitors by discriminatory analysis-based molecular docking and biological evaluation 期刊论文
ARCHIV DER PHARMAZIE, 2019, 卷号: 352, 期号: 7, 页码: 9
作者:  Cheng, Gang;  Mei, Xiao-Bing;  Yan, You-You;  Chen, Jing;  Zhang, Bo
收藏  |  浏览/下载:9/0  |  提交时间:2020/07/01
The dynamic conformational landscape of the protein methyltransferase SETD8 期刊论文
ELIFE, 2019, 卷号: 8, 页码: 76
作者:  Chen, Shi;  Wiewiora, Rafal P.;  Meng, Fanwang;  Babault, Nicolas;  Ma, Anqi
收藏  |  浏览/下载:11/0  |  提交时间:2020/07/01
Discovery of novel indoleaminopyrimidine NIK inhibitors based on molecular docking-based support vector regression (SVR) model 期刊论文
CHEMICAL PHYSICS LETTERS, 2019, 卷号: 718, 页码: 38-45
作者:  Ye, Qing;  Li, Qiu;  Gao, Anhui;  Ying, Huazhou;  Cheng, Gang
收藏  |  浏览/下载:6/0  |  提交时间:2020/07/01
Concentration Dependent Effects of Ca~(2+) and Mg~(2+) on the Phosphatidylethanolamine-Phosphatidylglycerol Bilayer 期刊论文
Acta Physica-Chimica Sinica, 2019, 卷号: 35, 期号: 8, 页码: 840
作者:  Zhang Tao;  Qiu Yunguang;  Luo Qichao;  Cheng Xi;  Zhao Lifen
收藏  |  浏览/下载:11/0  |  提交时间:2020/12/24


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