Structure-Based Site of Metabolism (SOM) Prediction of Ligand for CYP3A4 Enzyme: Comparison of Glide XP and Induced Fit Docking (IFD)

Metabolism is one of the prime reasons where most of drugs fail to accomplish their clinical trials. The enzyme CYP3A4, which belongs to the superfamily of cytochrome P450 enzymes (CYP), helps in the metabolism of a large number of drugs in the body. The enzyme CYP3A4 catalyzes oxidative chemical pr...

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Detalles Bibliográficos
Autores principales: Lokwani, Deepak K., Sarkate, Aniket P., Karnik, Kshipra S., Nikalje, Anna Pratima G., Seijas, Julio A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2020
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7181161/
https://www.ncbi.nlm.nih.gov/pubmed/32244772
http://dx.doi.org/10.3390/molecules25071622

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7181161/
https://www.ncbi.nlm.nih.gov/pubmed/32244772
http://dx.doi.org/10.3390/molecules25071622

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