Decoys Selection in Benchmarking Datasets: Overview and Perspectives

Virtual Screening (VS) is designed to prospectively help identifying potential hits, i.e., compounds capable of interacting with a given target and potentially modulate its activity, out of large compound collections. Among the variety of methodologies, it is crucial to select the protocol that is t...

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Bibliographic Details
Main Authors: Manon Réau, Florent Langenfeld, Jean-François Zagury, Nathalie Lagarde, Matthieu Montes
Format: Article
Language:English
Published: Frontiers Media S.A. 2018-01-01
Series:Frontiers in Pharmacology
Subjects:
Online Access:http://journal.frontiersin.org/article/10.3389/fphar.2018.00011/full