Application of an R-group search technique into molecular design of HIV-1 integrase inhibitors

Application of an R-group search technique into molecular design of HIV-1 integrase inhibitors

In this paper, a three-dimensional quantitative structure-activity relationship (3D-QSAR) study for 62 HIV-1 integrase(IN) inhibitors was established using Topomer CoMFA. The multiple correlation coefficient of fitting, cross validation and external validation were 0.942, 0.670 and 0.748...

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Bibliographic Details
Main Authors:	Tong Jian-Bo, Bai Min, Zhao Xiang
Format:	Article
Language:	English
Published:	Serbian Chemical Society 2016-01-01
Series:	Journal of the Serbian Chemical Society
Subjects:	quantitative structure-activity relationship(QSAR) integrase inhibitors Topomer CoMFA Topomer search new inhibitors’ design
Online Access:	http://www.doiserbia.nb.rs/img/doi/0352-5139/2016/0352-51391600003T.pdf

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