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| Computational Study on the Drug Resistance Mechanism against HCV NS3/4A Protease Inhibitors Vaniprevir and MK-5172 by the Combination Use of Molecular Dynamics Simulation, Residue Interaction Network, and Substrate Envelope Analysis 期刊论文 JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2014, 卷号: 54, 期号: 2 - 收藏  |  浏览/下载:3/0  |  提交时间:2014/12/05 |
| Binding mechanism of Orange G to human serum albumin: Saturation transfer difference-NMR, spectroscopic and computational techniques 期刊论文 DYES AND PIGMENTS, 2013, 卷号: 98, 期号: 2 - 收藏  |  浏览/下载:64/0  |  提交时间:2014/12/05
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| Characterization of Zn-Containing Metal-Organic Frameworks by Solid-State 67Zn NMR Spectroscopy and Computational Modeling 期刊论文 CHEMISTRY-A EUROPEAN JOURNAL, 2012, 卷号: 18, 期号: 39 - 收藏  |  浏览/下载:3/0  |  提交时间:2014/12/05
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| Molecular mechanism of HIV-1 integrase-vDNA interactions and strand transfer inhibitor action: A molecular modeling perspective 期刊论文 JOURNAL OF COMPUTATIONAL CHEMISTRY, 2012, 卷号: 33, 期号: 5 - 收藏  |  浏览/下载:3/0  |  提交时间:2014/12/05
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| Molecular Modeling Study of Checkpoint Kinase 1 Inhibitors by Multiple Docking Strategies and Prime/MM-GBSA Calculation 期刊论文 JOURNAL OF COMPUTATIONAL CHEMISTRY, 2011, 卷号: 32, 期号: 13 - 收藏  |  浏览/下载:3/0  |  提交时间:2014/12/05
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| A Combined Molecular Modeling Study on Gelatinases and Their Potent Inhibitors 期刊论文 JOURNAL OF COMPUTATIONAL CHEMISTRY, 2010, 卷号: 31, 期号: 1 - 收藏  |  浏览/下载:2/0  |  提交时间:2014/12/05
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| QSAR Study of Malonyl-CoA Decarboxylase Inhibitors Using GA-MLR and a New Strategy of Consensus Modeling 期刊论文 JOURNAL OF COMPUTATIONAL CHEMISTRY, 2008, 卷号: 29, 期号: 16 - 收藏  |  浏览/下载:4/0  |  提交时间:2014/12/05
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| Elucidation of chiral recognition processes of macrocyclic antibiotic vancomycin 期刊论文 SAR AND QSAR IN ENVIRONMENTAL RESEARCH, 2006, 卷号: 17, 期号: 3 - 收藏  |  浏览/下载:6/0  |  提交时间:2014/12/05
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