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Critical target identification and human health risk ranking of metal ions based on mechanism-driven modeling 期刊论文
CHEMOSPHERE, 2022, 卷号: 301, 页码: 9
作者:  Wang, Xiaoqing;  Teng, Yuefa;  Ji, Chenglong;  Wu, Huifeng;  Li, Fei
收藏  |  浏览/下载:45/0  |  提交时间:2022/07/26
Laboratory bioassay, greenhouse experiment and 3D-QSAR studies on berberine analogues: a search for new herbicides based on natural products 期刊论文
PEST MANAGEMENT SCIENCE, 2021, 页码: 14
作者:  Zhang, Xiaohong;  Zhu, Tingfei;  Bi, Xiaoyang;  Yang, Sifan;  Huang, Jiguang
收藏  |  浏览/下载:42/0  |  提交时间:2021/05/24
Comparative cytotoxicity of halogenated aromatic DBPs and implications of the corresponding developed QSAR model to toxicity mechanisms of those DBPs: Binding interactions between aromatic DBPs and catalase play an important role 期刊论文
WATER RESEARCH, 2020, 卷号: 170, 页码: 1-13
作者:  Zhang, Zhenxuan;  Zhu, Qingyao;  Huang, Cui;  Yang, Mengting;  Li, Juying
收藏  |  浏览/下载:40/0  |  提交时间:2021/09/14
Bioactivity Prediction Based on Matched Molecular Pair and Matched Molecular Series Methods 期刊论文
CURRENT PHARMACEUTICAL DESIGN, 2020, 卷号: 26, 期号: 33, 页码: 4195-4205
作者:  Ding, Xiaoyu;  Cui, Chen;  Wang, Dingyan;  Zhao, Jihui;  Zheng, Mingyue
收藏  |  浏览/下载:15/0  |  提交时间:2020/12/21
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:25/0  |  提交时间:2022/01/19
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
Pharmacophore-based drug design for the identification of novel butyrylcholinesterase inhibitors against Alzheimer's disease 期刊论文
PHYTOMEDICINE, 2019, 卷号: 54, 期号: 2, 页码: 278-290
作者:  Jiang, YY (Jiang, Yingying)[ 2 ];  Gao, HW (Gao, Hongwei)[ 1,2 ]
收藏  |  浏览/下载:47/0  |  提交时间:2019/03/19
3D-QSAR/HQSAR-based analysis of bioconcentration and molecular modification of monophenyl aromatic compounds. 期刊论文
Turkish Journal of Chemistry, 2019, 卷号: Vol.43 No.1, 页码: 286-306
作者:  Qing LI;  Wenwen GU;  Yu LI
收藏  |  浏览/下载:57/0  |  提交时间:2019/12/17
Artificial intelligence in drug design 期刊论文
SCIENCE CHINA-LIFE SCIENCES, 2018, 卷号: 61, 期号: 10, 页码: 1191-1204
作者:  Zhong, Feisheng;  Xing, Jing;  Li, Xutong;  Liu, Xiaohong;  Fu, Zunyun
收藏  |  浏览/下载:29/0  |  提交时间:2019/01/08


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