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Insights into an Original Pocket-Ligand Pair Classification: A Promising Tool for Ligand Profile Prediction

Pockets are today at the cornerstones of modern drug discovery projects and at the crossroad of several research fields, from structural biology to mathematical modeling. Being able to predict if a small molecule could bind to one or more protein targets or if a protein could bind to some given liga...

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Detalhes bibliográficos
Main Authors: Pérot, Stéphanie, Regad, Leslie, Reynès, Christelle, Spérandio, Olivier, Miteva, Maria A., Villoutreix, Bruno O., Camproux, Anne-Claude
Formato: Artigo
Idioma:Inglês
Publicado em: Public Library of Science 2013
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3688729/
https://ncbi.nlm.nih.gov/pubmed/23840299
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1371/journal.pone.0063730
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