中国科学院机构知识库网格系统: 检索

浏览/检索结果: 共3条，第1-3条

帮助

条数/页：排序方式：
	THE INFLUENCE OF SUBSTITUENT ELECTRONIC EFFECT ON ETHYLENE OLIGOMERIZATION ACTIVITIES OF BIS(IMINO)PYRIDYL Fe(II) CATALYSTS: A COMBINED MOLECULAR MECHANICS AND CHARGE EQUILIBRATION METHOD 期刊论文 OAI收割 CHINESE JOURNAL OF POLYMER SCIENCE, 2009, 卷号: 27, 期号: 5, 页码: 711-717 作者: Li, Hua-yi; Duan, Bao-gen; Hu, You-liang \| 收藏 \| 浏览/下载：15/0 \| 提交时间：2019/04/09 Ethylene Oligomerization Fe Catalyst Molecular Mechanics (Mm) Net Charge Equilibration (Qeq)
	Comparative molecular dynamics simulations of histone deacetylase-like protein: binding modes and free energy analysis to hydroxamic acid inhibitors 期刊论文 iSwitch采集 Proteins-structure function and bioinformatics, 2008, 卷号: 73, 期号: 1, 页码: 134-149 作者: Yan, Chunli; Xiu, Zhilong; Li, Xiaohui; Li, Shenmin; Hao, Ce 收藏 \| 浏览/下载：23/0 \| 提交时间：2019/05/09 Histone deacetylase Histone deacetylase-like protein Molecular dynamics simulation Molecular mechanics-poisson-boltzmann surface area (mm-pbsa) method Molecular mechanics generalized born surface area (mm-gbsa) Mutagenesis Hydroxamic acid inhibitor
	Using fractal to solve the multiple minima problem in molecular mechanics calculation 期刊论文 OAI收割 JOURNAL OF COMPUTATIONAL CHEMISTRY, 2000, 卷号: 21, 期号: 12, 页码: 1101-1108 作者: Xu, YZ; Ouyang, Q; Wu, JG; Yorke, JA; Xu, GX \| 收藏 \| 浏览/下载：22/0 \| 提交时间：2019/04/09 Mm3 Molecular Mechanics Pentential Surface Conformer Fractal Basin Boundaries