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CORC

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Homology modeling and 3D-QSAR study of benzhydrylpiperazine delta opioid receptor agonists 期刊论文
COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2019, 卷号: 83, 页码: 9
作者:  Pan, Chenling;  Meng, Hao;  Zhang, Shuqun;  Zuo, Zhili;  Shen, Yuehai
收藏  |  浏览/下载：24/0  |  提交时间：2020/03/18
Computational Insight Into the Small Molecule Intervening PD-L1 Dimerization and the Potential Structure-Activity Relationship 期刊论文
FRONTIERS IN CHEMISTRY, 2019, 卷号: 7, 页码: 15
作者:  Shi, Danfeng;  An, Xiaoli;  Bai, Qifeng;  Bing, Zhitong;  Zhou, Shuangyan
收藏  |  浏览/下载：24/0  |  提交时间：2022/01/19
Designing of novel ERR gamma inverse agonists by molecular modeling studies of docking and 3D-QSAR on hydroxytamoxifen derivatives 期刊论文
MEDICINAL CHEMISTRY RESEARCH, 2019, 卷号: 28, 期号: 10, 页码: 1661-1673
作者:  Li, Rui;  Du, Yongli;  Shen, Jingkang
收藏  |  浏览/下载：7/0  |  提交时间：2020/07/01
Exploration of the structure-activity relationship and druggability of novel oxazolidinone-based compounds as Gram-negative antibacterial agents 期刊论文
ARCHIV DER PHARMAZIE, 2019, 页码: 13
作者:  Ding, Shi;  Ji, Jing-Chao;  Zhang, Ming-Juan;  Yang, Yu-She;  Wang, Rui
收藏  |  浏览/下载：6/0  |  提交时间：2020/07/01
Predictive deep learning models for environmental properties: the direct calculation of octanol-water partition coefficients from molecular graphs 期刊论文
GREEN CHEMISTRY, 2019, 卷号: 21, 期号: 16, 页码: 4555-4565
作者:  Wang, Zihao;  Su, Yang;  Shen, Weifeng;  Jin, Saimeng;  Clark, James H.
收藏  |  浏览/下载：59/0  |  提交时间：2019/10/18
The critical factors affecting typical organophosphate flame retardants to mimetic biomembrane: An integrated in vitro and in silico study 期刊论文
CHEMOSPHERE, 2019, 卷号: 226, 页码: 159-165
作者:  Wang, XQ;  Meng, XJ;  Li, F;  Ding, JW;  Ji, CL
收藏  |  浏览/下载：35/0  |  提交时间：2020/07/08
Cytotoxic Trichothecene Macrolides Produced by the Endophytic Myrothecium roridum 期刊论文
JOURNAL OF NATURAL PRODUCTS, 2019, 卷号: 82, 期号: 6, 页码: 1503-1509
作者:  Shen, Li;  Ai, Chun-Zhi;  Song, Yong-Chun;  Wang, Feng-Wu;  Jiao, Rui-Hua
收藏  |  浏览/下载：62/0  |  提交时间：2019/12/02
Identification of potential AMPK activator by pharmacophore modeling, molecular docking and QSAR study 期刊论文
COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2019, 卷号: 79, 页码: 165-176
作者:  Li, Yingying;  Peng, Jiale;  Li, Penghua;  Du, Haibo;  Li, Yaping
收藏  |  浏览/下载：66/0  |  提交时间：2019/07/29
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
Discovery of novel indoleamine 2,3-dioxygenase 1 (IDO1) inhibitors by virtual screening 期刊论文
COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2019, 卷号: 78, 页码: 306-316
作者:  Zhou, Yeheng;  Peng, Jiale;  Li, Penghua;  Du, Haibo;  Li, Yaping
收藏  |  浏览/下载：58/0  |  提交时间：2019/03/25

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