中国科学院研究生院学报2009，Vol.26Issue(2)：280-287,8.
老年痴呆相关蛋白靶标结构与功能关系的分子动力学模拟
Molecular dynamics simulations studies on the structure-function relationship of protein targets related to Alzheimer's disease
许叶春 1蒋华良1
作者信息
- 1. 中国科学院上海药物研究所药物发现与设计中心,上海,201203
- 折叠
摘要
Abstract
In the present thesis, the conformational changes of β-amyloid peptide, the dynamic binding and unbinding processes of huperzine A to acetylcholinesterase, and the conformational movement associated with the open or close gating mechanism of nicotinic acetylcholine receptor have been investigated using conventional and/or steered molecular dynamics simulations, gaining new and useful insights for the pathogenetic mechanism of Alzheimer' s disease (AD), and providing new clues for discovering new anti-AD drugs.关键词
老年痴呆症/分子动力学模拟/β-淀粉样多肽/乙酰胆碱酯酶/石杉碱甲/烟碱乙酰胆碱受体Key words
Alzheimer's disease/molecular dynamics simulation/β-amyloid peptide/acetylcholinesterase/huperzine A/nicotinic acetylcholine receptor分类
医药卫生引用本文复制引用
许叶春,蒋华良..老年痴呆相关蛋白靶标结构与功能关系的分子动力学模拟[J].中国科学院研究生院学报,2009,26(2):280-287,8.
