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浏览/检索结果: 共6条，第1-6条 帮助 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 Resistance mechanism of the oncogenic beta 3-alpha C deletion mutation in BRAF kinase to dabrafenib and vemurafenib revealed by molecular dynamics simulations and binding free energy calculations 期刊论文 CHEMICAL BIOLOGY & DRUG DESIGN, 2019, 卷号: 93, 期号: 2, 页码: 177-187 作者:  Niu, Yuzhen;  Zhang, Yan;  Yao, Xiaojun 收藏  |  浏览/下载：4/0  |  提交时间：2019/12/11 binding free energy calculation  BRAF inhibitors  drug resistance  molecular dynamics simulation  residue interaction network analysis   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 Mechanism of flexibility control for ATP access of hepatitis C virus NS3 helicase 期刊论文 JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2013, 卷号: 31, 期号: 2, 页码: 129-141 作者:  Palla, M;  Chen, CP;  Zhang, Y;  Li, JY;  Ju, JY 收藏  |  浏览/下载：14/0  |  提交时间：2016/04/08 molecular dynamics simulation  ATP-binding cleft  pairwise distance analysis  RMSF analysis  hinge motion   Exploring the Molecular Mechanism of Cross-Resistance to HIV-1 Integrase Strand Transfer Inhibitors by Molecular Dynamics Simulation and Residue Interaction Network Analysis 期刊论文 JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2013, 卷号: 53, 期号: 1 - 收藏  |  浏览/下载：2/0  |  提交时间：2014/12/05 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[*] 收藏  |  浏览/下载：7/0  |  提交时间：2013/09/24 Inter-protein coevolution  Oncogenic mutations  Melanoma  Molecular dynamics simulation  CDK6-CDKN2A complex   Combined X-ray and NMR Analysis of the Stability of the Cyclotide Cystine Knot Fold That Underpins Its Insecticidal Activity and Potential Use as a Drug Scaffold 期刊论文 JOURNAL OF BIOLOGICAL CHEMISTRY, 2009, 卷号: 284, 期号: 16, 页码: 10672-10683 作者:  Wang, Conan K.;  Hu, Shu-Hong;  Martin, Jennifer L.;  Sjogren, Tove;  Hajdu, Janos 收藏  |  浏览/下载：14/0  |  提交时间：2012/03/21 Ligusticum Chuanxiong  4-pentylcyclohex-3-ene-1 Alpha  Phthalide Derivatives  2 Beta-diol  Ligusticoside a  Wallichii  Phthalides  Constituents  Derivatives  Rhizomes  Dimers