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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：144/0  |  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：357/132  |  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：893/145  |  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：617/154  |  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：494/117  |  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 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：846/206  |  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：1211/270  |  提交时间：2011/12/14
Progesterone Receptor  Comparative Molecular Field Analysis (Comfa)  Comparative Molecular Similarity Indices Analysis (Comsia)  Inhibitor  Qsar  
STUDY ON THE INTERACTIONS OF Smac MIMETICS WITH XIAP-BIR3 DOMAIN BY DOCKING AND MOLECULAR DYNAMICS SIMULATIONS 期刊论文
JOURNAL OF THEORETICAL & COMPUTATIONAL CHEMISTRY, 2010, 卷号: 9, 期号: 4, 页码: 797-812
作者:  Ling, Baoping;  Zhang, Rui;  Wang, Zhiguo;  Liu, Yongjun;  Liu, Chengbu
浏览  |  Adobe PDF(1006Kb)  |  收藏  |  浏览/下载：675/141  |  提交时间：2011/12/13
Inhibitor Of Apoptosis Protein (Iap)  Smac Mimetics  Molecular Docking  Molecular Dynamics Simulations  Binding Free Energy  
Theoretical studies on the interaction of guanine riboswitch with guanine and its closest analogues 期刊论文
MOLECULAR SIMULATION, 2010, 卷号: 36, 期号: 12, 页码: 929-938
作者:  Ling, Baoping;  Zhang, Rui;  Wang, Zhiguo;  Dong, Lihua;  Liu, Yongjun;  Zhang, Changqiao;  Liu, Chengbu
浏览  |  Adobe PDF(1430Kb)  |  收藏  |  浏览/下载：707/148  |  提交时间：2011/12/13
Guanine  Guanine Riboswitch  Docking  Molecular Dynamics  Binding Energy