钾离子通道开放剂的药效团模型分析

被引:5
作者
陈红明
周家驹
谢桂荣
庞素华
机构
[1] 中国科学院计算机化学开放实验室!北京,,中国科学院计算机化学开放实验室!北京,,中国科学院计算机化学开放实验室!北京,,中国科学院计算机化学开放实验室!北京,
关键词
钾离子通道开放剂; 比较分子场分析; QSAR;
D O I
暂无
中图分类号
O641 [结构化学];
学科分类号
070304 ; 081704 ;
摘要
In this paper, a set of ATP sensitive K+ channel openers (KCO), whose structure are different, were investigated with the aim to develope our previously defined KCO's pharmacophore model.To validate the effectiveness of the pharmacophore model, A comparative molecule field analysis (CoMFA) was proceeded, aligning the molecules according to the requirernent of the model, and good results were obtained. This pharmacophore model may be a start point to design new KCO compounds.
引用
收藏
页码:101 / 105
页数:5
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