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Identification of a Novel Class of BRD4 Inhibitors by Computational Screening and Binding Simulations

[Image: see text] Computational screening is a method to prioritize small-molecule compounds based on the structural and biochemical attributes built from ligand and target information. Previously, we have developed a scalable virtual screening workflow to identify novel multitarget kinase/bromodoma...

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Detalhes bibliográficos
Publicado no:ACS Omega
Main Authors: Allen, Bryce K., Mehta, Saurabh, Ember, Stuart W. J., Zhu, Jin-Yi, Schönbrunn, Ernst, Ayad, Nagi G., Schürer, Stephan C.
Formato: Artigo
Idioma:Inglês
Publicado em: American Chemical Society 2017
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC5579542/
https://ncbi.nlm.nih.gov/pubmed/28884163
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acsomega.7b00553
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