Binding Selectivity of Inhibitors toward Bromodomains BAZ2A and BAZ2B Uncovered by Multiple Short Molecular Dynamics Simulations and MM-GBSA Calculations

[Image: see text] Two Bromodomain-Containing proteins BAZ2A and BAZ2B are responsible for remodeling chromatin and regulating noncoding RNAs. As for our current studies, integration of multiple short molecular dynamics simulations (MSMDSs) with molecular mechanics generalized Born surface area (MM-G...

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Detalles Bibliográficos
Autores principales: Wang, Lifei, Wang, Yan, Yang, Zhiyong, Xu, Shuobo, Li, Hongyun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8154142/
https://www.ncbi.nlm.nih.gov/pubmed/34056358
http://dx.doi.org/10.1021/acsomega.1c00687

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8154142/
https://www.ncbi.nlm.nih.gov/pubmed/34056358
http://dx.doi.org/10.1021/acsomega.1c00687

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