Article
Established and emerging trends in computational drug discovery in the structural genomics era.
Chemistry & biology - 27 Jan 2012
Taboureau Olivier, Baell Jonathan B, Fernández-Recio Juan, Villoutreix Bruno O
Abstract excerpt
Bioinformatics and chemoinformatics approaches contribute to hit discovery, hit-to-lead optimization, safety profiling, and target identification and enhance our overall understanding of the health and disease states. A vast repertoire of computational methods has been reported and increasingly combined in order to address more and more challenging targets or complex molecular mechanisms in the context of...
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