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3D-QSAR and virtual screening of 5α-reductase Ⅱ inhibitors of 6-azasteroids

Three-dimensional quantitative structure-activity relationship analysis of 37 6-azasteroids inhibitors was carried out by Topomer CoMFA. The new model’s cross validation and correlation coefficient were q2=0.774 and r2=0.965, respectively. The results show that the model has good prediction ability...

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Principais autores: LIU Hua, PU Ling-Ling, YANG Jing, SONG Hai-Xing, LIANG Gui-Zhao
Formato: Artigo
Idioma:Inglês
Publicado: Editorial Department of Journal of Sichuan University (Natural Science Edition) 2018-01-01
Series:四川大学学报. 自然科学版
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Acceso en liña:http://science.scu.edu.cn/thesisDetails?columnId=45827567&Fpath=home&index=0
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