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Molecular dynamics simulations and statistical coupling analysis reveal functional coevolution network of oncogenic mutations in the CDKN2A-CDK6 complex 期刊论文
FEBS LETTERS, 2013, 卷号: 587, 期号: 2, 页码: 136-141
作者:  Wang JW;  Zhao YQ;  Wang YJ;  Huang JF*;  huangjf@mail.kiz.ac.cn
Adobe PDF(1218Kb)  |  收藏  |  浏览/下载:544/6  |  提交时间:2013/09/24
Inter-protein Coevolution  Oncogenic Mutations  Melanoma  Molecular Dynamics Simulation  Cdk6-cdkn2a Complex  
Molecular dynamics simulation of PNPLA3 I148M polymorphism reveals reduced substrate access to the catalytic cavity 期刊论文
PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS, 2013, 卷号: 81, 期号: 3, 页码: 406-414
作者:  Xin YN;  Zhao YQ;  Lin ZH;  Jiang XJ;  Xuan SY*;  Huang JF*;  dxyxyn@163.com;  huangjf@mail.kiz.ac.cn
Adobe PDF(1086Kb)  |  收藏  |  浏览/下载:3945/10  |  提交时间:2013/03/04
Pnpla3  Nonalcoholic Fatty Liver Disease  Missense Mutation  Molecular Dynamics Simulations  
Characterize dynamic conformational space of human CCR5 extracellular domain by molecular modeling and molecular dynamics simulation 期刊论文
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 2004, 卷号: 673, 期号: 1-3, 页码: 133-143
作者:  Liu SQ;  Shi XF;  Liu CQ;  Sun ZR*;  shuqunliu@tsinghua.org.cn
Adobe PDF(563Kb)  |  收藏  |  浏览/下载:87/2  |  提交时间:2010/08/24
Ccr5  Molecular Dynamics Simulation  Extracellular Domains  Disulfide Bond  Interaction  Ligand Binding  
Structural and functional characterization of the human CCR5 receptor in complex with HIV gp120 envelope glycoprotein and CD4 receptor by molecular modeling studies 期刊论文
JOURNAL OF MOLECULAR MODELING, 2003, 卷号: 9, 期号: 5, 页码: 329-336
作者:  Liu SQ;  Shi XF;  Sun ZR*;  sunzhr@mail.tsinghua.edu.cn
Adobe PDF(401Kb)  |  收藏  |  浏览/下载:320/2  |  提交时间:2010/08/24
Ccr5  Gp120  Interaction  Docking  Molecular Dynamics Simulation  Complex  
Structural analysis of human CCR2b and primate CCR2b by molecular modeling and molecular dynamics simulation 期刊论文
JOURNAL OF MOLECULAR MODELING, 2002, 卷号: 8, 期号: 7, 页码: 217-222
作者:  Shi XF;  Liu SX*;  Xiangyu JS;  Zhang YP;  Huang JF;  Liu CQ
Adobe PDF(214Kb)  |  收藏  |  浏览/下载:1537/4  |  提交时间:2010/08/24
Ccr2 Structure  Molecular Dynamics  Electrostatic Potentials