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浏览/检索结果: 共11条，第1-10条 帮助 限定条件 发表日期：2012    学科主题：物理化学     已选(0)清除 条数/页：5101520253035404550556065707580859095100   排序方式：请选择作者升序作者降序题名升序题名降序发表日期升序发表日期降序提交时间升序提交时间降序 Prominently Improved Hydrogen Purification and Dispersive Metal Binding for Hydrogen Storage by Substitutional Doping in Porous Graphene 期刊论文 journal of physical chemistry c, 2012, 卷号: 116, 期号: 40, 页码: 21291-21296 作者:  Lu, Ruifeng;  Rao, Dewei;  Lu, Zelin;  Qian, Jinchao;  Li, Feng 收藏  |  浏览/下载：26/0  |  提交时间：2013/10/11 Design, synthesis and structure changes of Au-Ag and Au-Cu nanoparticle catalysts 会议论文 the 6th international conference on gold science, technology and its applications　, 东京, 2012-9-5 张涛 收藏  |  浏览/下载：10/0  |  提交时间：2013/10/10 Molecular Dynamic Simulation Insights into the Normal State and Restoration of p53 Function 期刊论文 international journal of molecular sciences, 2012, 卷号: 13, 期号: 8, 页码: 9709-9740 作者:  Fu, Ting;  Min, Hanyi;  Xu, Yong;  Chen, Jianzhong;  Li, Guohui 收藏  |  浏览/下载：13/0  |  提交时间：2013/10/11 p53  MDM2  MDMX  molecular dynamic simulation  conformational change  protein-protein interaction  protein-ligand interaction   Recent density functional theory model calculations of drug metabolism by cytochrome P450 期刊论文 coordination chemistry reviews, 2012, 卷号: 256, 期号: 11-12, 页码: 1137-1150 作者:  Li, Dongmei;  Wang, Yong;  Han, Keli 收藏  |  浏览/下载：14/0  |  提交时间：2013/10/11 Density functional theory  Compound I  Hydrogen atom transfer  Two-state reactivity   Mesoporous metal-organic frameworks: design and applications 期刊论文 energy & environmental science, 2012, 卷号: 5, 期号: 6, 页码: 7508-7520 作者:  Song, Lifang;  Zhang, Jian;  Sun, Lixian;  Xu, Fen;  Li, Fen 收藏  |  浏览/下载：94/0  |  提交时间：2013/10/11 Exploring the structure requirement for KC theta inhibitory activity of pyridinecarbonitrile derivatives: an in silico analysis 期刊论文 journal of molecular graphics & modelling, 2012, 卷号: 34, 页码: 76-88 作者:  Li, Yan;  Hao, Ming;  Ren, Hong;  Zhang, Shuwei;  Wang, Xia 收藏  |  浏览/下载：26/0  |  提交时间：2013/10/11 Protein kinase C theta  CoMFA  CoMSIA  3D-QSAR  Molecular docking  Molecular dynamics   Identification of Novel Potential beta-N-Acetyl-D-Hexosaminidase Inhibitors by Virtual Screening, Molecular Dynamics Simulation and MM-PBSA Calculations 期刊论文 international journal of molecular sciences, 2012, 卷号: 13, 期号: 4, 页码: 4545-4563 作者:  Liu, Jianling;  Liu, Mengmeng;  Yao, Yao;  Wang, Jinan;  Li, Yan 收藏  |  浏览/下载：24/0  |  提交时间：2013/10/11 beta-N-acetyl-D-hexosaminidase  OfHex1  inhibitor  virtual screening  molecular dynamics  MM/PBSA   Investigation of Family 18 Chitinases and Inhibitors by Computer-Aided Approaches 期刊论文 current drug targets, 2012, 卷号: 13, 期号: 4, 页码: 502-511 作者:  Chu, Huiying;  Wang, Jinan;  Shen, Hujun;  Yang, Yongliang;  Zhu, Weiliang 收藏  |  浏览/下载：21/0  |  提交时间：2013/10/11 Chitinases  chitinase inhibitors  computer-aided approach   Synthesis, tunable two and three-photon absorption properties of triazine derivatives by branches 期刊论文 Dyes & Pigments, 2012, 卷号: 45, 期号: 94, 页码: 290—295 欧阳新华，Heping Zeng，Wei Ji，葛子义; Shuiming Zeng a, Xinhua Ouyang b,*, Heping Zeng a,*, Wei Ji c,*, Ziyi Ge b,* 收藏  |  浏览/下载：7/0  |  提交时间：2013/12/16 Systematic morphology and phase control of Mg-ptcda coordination polymers by Ostwald ripening and self-templating 期刊论文 journal of materials chemistry, 2012, 卷号: 22, 期号: 17, 页码: 8470-8475 作者:  Zhao, Jiao;  Su, Panpan;  Zhao, Yaopeng;  Li, Mingrun;  Yang, Yan 收藏  |  浏览/下载：28/0  |  提交时间：2013/10/11