Discriminatory analysis based molecular docking study for in silico identification of epigallocatechin-3-gallate (EGCG) derivatives as B-Raf V600E inhibitors

Virtual screening and biological testing were utilized to identify novel B-Raf V600E inhibitors. The employed LigandFit program was evaluated by examining the accuracy of the binding conformation prediction and binding affinity estimation (scoring function) via discriminative analysis training. Ten...

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Veröffentlicht in:	RSC advances 2017, Vol.7 (71), p.44820-44826
Hauptverfasser:	Ying, Huazhou, Xie, Jiangfeng, Liu, Xingguo, Yao, Tingting, Dong, Xiaowu, Hu, Chunqi
Format:	Artikel
Sprache:	eng
Online-Zugang:	Volltext
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