Computational insight into crucial binding features for metabolic specificity of cytochrome P450 17A1

In present study we aimed to explore the possible structural feature of Cytochrome P450 (CYP) 17A1 that contributes to the metabolic specificity. The predicable 3D-QSAR (Quantitative Structure-Activity Relationships) models were first developed with CoMFA (Comparative Molecular Field Analysis) and C...

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Bibliographic Details
Main Authors: Chun-Zhi Ai, Hui-Zi Man, Yasmeen Saeed, Du-Chu Chen, Li-Hua Wang, Yi-Zhou Jiang
Format: Article
Language:English
Published: Elsevier 2019-01-01
Series:Informatics in Medicine Unlocked
Online Access:http://www.sciencedirect.com/science/article/pii/S2352914819300188