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A new aromatic glycoside and its anti-proliferative activities from the leaves of Bergenia purpurascens 期刊论文
NATURAL PRODUCT RESEARCH, 2018, 卷号: 32, 期号: 6, 页码: 668-675
作者:  Zhang, Shan-Shan;  Liao, Zhi-Xin;  Huang, Ri-Zhen;  Gong, Cheng-Cheng;  Ji, Lan-Ju;  Sun, Hong-Fa
收藏  |  浏览/下载：147/0  |  提交时间：2018/07/25
Bergenia Purpurascens  Aromatic Glycoside  Cancer Cell Lines  Anti-proliferative Activities  Docking Model  
Design, preparation and characterization of cyclic RGDfK peptide modified poly(ethylene glycol)-block-poly(lactic acid) micelle for targeted delivery 期刊论文
MATERIALS SCIENCE & ENGINEERING C-MATERIALS FOR BIOLOGICAL APPLICATIONS, 2016, 卷号: 64, 页码: 303-309
作者:  Li, Caixia;  Wang, Wenlong;  Xi, Yuewei;  Wang, Jiexin;  Chen, Jian-Feng;  Yun, Jimmy;  Le, Yuan
收藏  |  浏览/下载：150/0  |  提交时间：2016/07/19
Target Drug Delivery  Rgdfk Peptide  Nano-micelle  Docking Calculations  
Novel Diketopiperazine Dihydroorotate Dehydrogenase Inhibitors Purified from Traditional Tibetan Animal Medicine Osteon Myospalacem Baileyi 期刊论文
CHEMICAL BIOLOGY & DRUG DESIGN, 2015, 卷号: 86, 期号: 4, 页码: 626-636
作者:  Jiang, Lei;  Wen, Huaixiu;  Shao, Yun;  Yu, Ruitao;  Liu, Zenggen;  Wang, Shuo;  Wang, Qilan;  Zhao, Xiaohui;  Zhang, Peng;  Tao, Yanduo;  Mei, Lijuan
浏览  |  Adobe PDF(1151Kb)  |  收藏  |  浏览/下载：359/133  |  提交时间：2015/12/17
Cyclic Dipeptides  Dihydroorotate Dehydrogenase Inhibitors  Osteon Myospalacem Baileyi  Tibetan Medicine  Two-dimensional Chromatography  
QM/MM study on the catalytic mechanism of cyclohexane-1,2-dione hydrolase (CDH) 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, 2013, 卷号: 133, 期号: 2
作者:  Zhu, Wenyou;  Liu, Yongjun;  Liu, YJ (reprint author), Shandong Univ, Sch Chem & Chem Engn, Key Lab Colloid & Interface Chem, Minist Educ, Jinan 250100, Shandong, Peoples R China.
Adobe PDF(693Kb)  |  收藏  |  浏览/下载：899/145  |  提交时间：2014/05/09
Cyclohexane-1  Reaction Mechanism  2-dione (Cdo)  Cyclohexane-1  Qm/mm  2-dione Hydrolase (Cdh)  Thiamine Diphosphate (Thdp)-dependent Enzyme  
Computational Study of Drugs by Integrating Omics Data with Kernel Methods 期刊论文
MOLECULAR INFORMATICS, 2013, 卷号: 32, 期号: 11-12, 页码: 930-941
作者:  Wang, Yongcui C.;  Deng, Naiyang;  Chen, Shilong;  Wang, Yong;  Wang, YCC (reprint author), Chinese Acad Sci, Northwest Inst Plateau Biol, Key Lab Adaptat & Evolut Plateau Biota, 23 Xinning Rd, Xining, Qinghai Provinc, Peoples R China.
Adobe PDF(1222Kb)  |  收藏  |  浏览/下载：621/154  |  提交时间：2014/05/09
Omics Data  Kernel Methods  Data Integration  Drug-targets  Atc-codes Of Drugs  Drug Repositioning  
Theoretical studies on the common catalytic mechanism of transketolase by using simplified models 期刊论文
JOURNAL OF MOLECULAR GRAPHICS & MODELLING, 2013, 卷号: 39, 页码: 23-28
作者:  Sheng, Xiang;  Liu, Yongjun;  Liu, Chengbu
Adobe PDF(955Kb)  |  收藏  |  浏览/下载：496/118  |  提交时间：2014/05/09
Transketolase  Density Functional Theory (Dft) Method  Reaction Mechanism  Thdp-dependent Enzyme  2-carbon Fragment Transfer  
Theoretical studies on the interaction of biphenyl inhibitors with Mycobacterium tuberculosis protein tyrosine phosphatase MptpB 期刊论文
JOURNAL OF MOLECULAR MODELING, 2012, 卷号: 18, 期号: 8, 页码: 3847-3856
作者:  Dong, Lihua;  Shi, Junyou;  Liu, Yongjun
浏览  |  Adobe PDF(890Kb)  |  收藏  |  浏览/下载：763/164  |  提交时间：2013/03/15
Tyrosine Phosphatase b  Biphenyl Inhibitor  Interaction  Molecular Docking  Molecular Dynamics Simulation  
Activation of beta(2)-Adrenergic Receptor Induced by Three Catecholamine Agonists: a Docking and Molecular Dynamics Study 期刊论文
CHEMICAL RESEARCH IN CHINESE UNIVERSITIES, 2012, 卷号: 28, 期号: 3, 页码: 493-499
作者:  Zhang Rui;  Dong Li-hua;  Ling Bao-ping;  Wang Zhi-guo;  Liu Yong-jun
收藏  |  浏览/下载：522/0  |  提交时间：2013/03/15
Beta(2)-adrenergic Receptor(Beta(2)Ar)  g Protein Coupled Receptor(Gpcr)  Molecular Dynamics  Agonist  Activation  
Theoretical Studies on the Conformational Change of Adenosine Kinase Induced by Inhibitors 期刊论文
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2011, 卷号: 111, 期号: 14, 页码: 3980-3990
作者:  Dong, Lihua;  Shi, Junyou;  Wang, Jinhu;  Liu, Yongjun
浏览  |  Adobe PDF(1320Kb)  |  收藏  |  浏览/下载：849/206  |  提交时间：2011/12/13
Adenosine Kinase (Ak)  Inhibitor  Conformational Change  Molecular Dynamic (Md)  
Receptor-based QSAR study for a series of 3,3-disubstituted-5-aryl oxindoles and 6-aryl benzimidazol-2-ones derivatives as progesterone receptor inhibitors 期刊论文
SAR AND QSAR IN ENVIRONMENTAL RESEARCH, 2011, 卷号: 22, 期号: 7-8, 页码: 775-799
作者:  Wang, J. H.;  Hou, Q. Q.;  Tang, K.;  Cheng, X. L.;  Dong, L. H.;  Liu, Y. J.;  Liu, C. B.
浏览  |  Adobe PDF(1310Kb)  |  收藏  |  浏览/下载：1218/270  |  提交时间：2011/12/14
Progesterone Receptor  Comparative Molecular Field Analysis (Comfa)  Comparative Molecular Similarity Indices Analysis (Comsia)  Inhibitor  Qsar