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浏览/检索结果: 共5条，第1-5条 帮助 限定条件 发表日期：2017     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 Virtual screening of B-Raf kinase inhibitors: A combination of pharmacophore modelling, molecular docking, 3D-QSAR model and binding free energy calculation studies 期刊论文 COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2017, 卷号: 70, 页码: 186-190 作者:  Zhang, Wen;  Qiu, Kai-Xiong;  Yu, Fang;  Xie, Xiao-Guang;  Zhang, Shu-Qun 收藏  |  浏览/下载：24/0  |  提交时间：2017/12/11 B-raf Kinase Inhibitors  Virtual Screening  Pharmacophore  Molecular Docking  3d Qsar  Binding Free Energy Calculation   Comparative QSAR studies using HQSAR, CoMFA, and CoMSIA methods on cyclic sulfone hydroxyethylamines as BACE1 inhibitors 期刊论文 COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2017, 卷号: 67, 期号: 1, 页码: 38-47 作者:  Zhang, Shuqun;  Lin, Zichun;  Pu, Yinglan;  Zhang, Yunqin;  Zhang, Li 收藏  |  浏览/下载：29/0  |  提交时间：2017/05/19 BACE1  AD  HQSAR  CoMFA  CoMSIA   Comparative QSAR studies using HQSAR, CoMFA, and CoMSIA methods on cyclic sulfone hydroxyethylamines as BACE1 inhibitors 期刊论文 COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2017, 卷号: 67, 页码: 38-47 作者:  Zhang, Shuqun;  Lin, Zichun;  Pu, Yinglan;  Zhang, Yunqin;  Zhang, Li 收藏  |  浏览/下载：25/0  |  提交时间：2019/01/08 BACE1  AD  HQSAR  CoMFA  CoMSIA   A new 3D conceptual structure modeling of biochars by molecular mechanic and molecular dynamic simulation 期刊论文 JOURNAL OF SOILS AND SEDIMENTS, 2017, 卷号: 17, 期号: 3, 页码: 641-655 作者:   收藏  |  浏览/下载：19/0  |  提交时间：2018/07/27 C-13 Nuclear Magnetic Resonance  3d Structure  Biochar  Conceptual Model  Elemental Concentration  Pyrolysis-gas Chromatography-mass Spectrometry  Molecular Simulation  Optimized Potential For Liquid Simulation Force Field   Virtual screening of B-Raf kinase inhibitors: A combination of pharmacophore modelling, molecular docking, 3D-QSAR model and binding free energy calculation studies 期刊论文 COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2017, 卷号: 70 作者:  Zhang, Wen;  Qiu, Kai-Xiong;  Yu, Fang;  Xie, Xiao-Guang;  Zhang, Shu-Qun 收藏  |  浏览/下载：3/0  |  提交时间：2019/12/04 B-Raf kinase inhibitors  Virtual screening  Pharmacophore  Molecular docking  3D QSAR  Binding free energy calculation