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Molecular Dynamics Investigations of Binding Mechanism for Triazoles Inhibitors to CYP51

The sterol 14α demethylase enzyme (CYP51) is an important target of fungal infections. However, the molecular mechanism between triazoles inhibitors and CYP51 remains obscure. In this study, we have investigated the binding mechanism and tunnel characteristic upon four triazoles inhibitors with CYP5...

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Detalles Bibliográficos
Autores principales:	Shi, Na, Zheng, Qingchuan, Zhang, Hongxing
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Frontiers Media S.A. 2020
Materias:	Molecular Biosciences
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7546855/ https://www.ncbi.nlm.nih.gov/pubmed/33102531 http://dx.doi.org/10.3389/fmolb.2020.586540

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