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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, 期号: 1, 页码: 38-47
作者:  Zhang, Shuqun;  Lin, Zichun;  Pu, Yinglan;  Zhang, Yunqin;  Zhang, Li;  Zuo, Zhili
浏览  |  Adobe PDF(1591Kb)  |  收藏  |  浏览/下载：361/69  |  提交时间：2017/05/19
Bace1  Ad  Hqsar  Comfa  Comsia  
Design and prediction of new acetylcholinesterase inhibitor via quantitative structure activity relationship of huprines derivatives 期刊论文
ARCHIVES OF PHARMACAL RESEARCH, 2016, 卷号: 39, 期号: 5, 页码: 591-602
作者:  Zhang, Shuqun;  Hou, Bo;  Yang, Huaiyu;  Zuo, Zhili
浏览  |  Adobe PDF(1125Kb)  |  收藏  |  浏览/下载：294/91  |  提交时间：2016/08/22
Ache  Ad  Hqsar  Comfa  Comsia  Huprines Inhibitors  
Protein-based alignment in 3D-QSAR of FBPase inhibitors 期刊论文
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2011, 卷号: 46, 期号: 3, 页码: 885-892
作者:  Yi, Ping;  Di, Ying-Tong;  Liu, Wei;  Hao, Xiao-Jiang;  Ming, Yong;  Huang, Du-Shu;  Yang, Jin;  Yi, Zhong-Zhou;  Li, Zi-Jing;  Yang, Rui-Dong;  Zhang, Ju-Cheng
Adobe PDF(777Kb)  |  收藏  |  浏览/下载：443/173  |  提交时间：2012/04/10
3d-qsar  Gold  Comfa  Fbpase  
Molecular docking-based 3D-QSAR studies of pyrrolo[3,4-c]pyrazole derivatives as Aurora-A inhibitors 期刊论文
MOLECULAR SIMULATION, 2011, 卷号: 37, 期号: 1, 页码: 31-42
He, G.; Qiu, M. H.; Li, R.; Song, X. R.; Zheng, X.; Shi, J. Y.; Xu, G. B.; Han, J.; Yu, L. T.; Yang, S. Y.; Chen, L. J.; Wei, Y. Q.
浏览  |  Adobe PDF(551Kb)  |  收藏  |  浏览/下载：396/127  |  提交时间：2012/10/12
Pyrrolo[3  4-c]Pyrazole Derivatives  3d-qsar  Molecular Docking  Comfa  Comsia  Kinase Inhibitors  Protein-kinase  Pharmacophore Model  Similarity Indexes  Analysis Comsia  Potent  Identification  Binding  Profile  Comfa  
3D QSAR studies on ketoamides of human cathepsin K inhibitors based on two different alignment methods 期刊论文
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2010, 卷号: 45, 期号: 2, 页码: 667-681
作者:  Pan, Xulin;  Tan, Ninghua;  Zeng, Guangzhi;  Huang, Huoqiang;  Yan, He
Adobe PDF(2690Kb)  |  收藏  |  浏览/下载：405/152  |  提交时间：2012/03/21
Cathepsin k  Comfa  Comsia  Ketoamides  
2D-and 3D-QSAR studies on 54 anti-tumor Rubiaceae-type cyclopeptides 期刊论文
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2009, 卷号: 44, 期号: 9, 页码: 3425-3432
作者:  Yan, He;  Pan, Xulin;  Tan, Ninghua;  Fan, Junting;  Zeng, Guangzhi;  Han, Hongjin
Adobe PDF(595Kb)  |  收藏  |  浏览/下载：623/329  |  提交时间：2012/04/05
Rubiaceae-type Cyclopeptides  Hqsar  Comfa  Comsia  Anti-tumor Activity  
3D-QSAR studies of Checkpoint Kinase Weel inhibitors based on molecular docking, CoMFA and CoMSIA 期刊论文
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2008, 卷号: 43, 期号: 5, 页码: 925-938
作者:  Yi, Ping;  Fang, Xin;  Qiu, Minghua
Adobe PDF(2704Kb)  |  收藏  |  浏览/下载：367/102  |  提交时间：2011/11/24
3d-qsar  Gold  Comfa  Comsia  Checkpoint Kinase Weel  
3D-QSAR and docking studies of aminopyridine carboxamide inhibitors of c-Jun N-terminal kinase-1 期刊论文
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2008, 卷号: 43, 期号: 3, 页码: 604-613
作者:  Yi, Ping;  Qiu, Minghua
Adobe PDF(2801Kb)  |  收藏  |  浏览/下载：340/167  |  提交时间：2011/11/24
3d-qsar  Gold  Comfa  C-jun N-terminal Kinase-1  
Design, synthesis, and SAR analysis of cytotoxic sinapyl alcohol derivatives 期刊论文
BIOORGANIC & MEDICINAL CHEMISTRY, 2006, 卷号: 14, 期号: 6, 页码: 2060-2071
作者:  Zou, HB;  Dong, SY;  Zhou, CX;  Hu, LH;  Wu, YH;  Li, HB;  Gong, JX;  Sun, LL;  Wu, XM;  Bai, H;  Fan, BT;  Hao, XJ;  Stockigt, J;  Zhao, Y
Adobe PDF(271Kb)  |  收藏  |  浏览/下载：398/155  |  提交时间：2012/03/21
Sinapyl Alcohol Derivatives  Synthesis  Cytotoxicity  Comfa Analysis