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Proteochemometric modeling in a Bayesian framework

Proteochemometrics (PCM) is an approach for bioactivity predictive modeling which models the relationship between protein and chemical information. Gaussian Processes (GP), based on Bayesian inference, provide the most objective estimation of the uncertainty of the predictions, thus permitting the e...

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Detalhes bibliográficos
Main Authors: Cortes-Ciriano, Isidro, van Westen, Gerard JP, Lenselink, Eelke Bart, Murrell, Daniel S, Bender, Andreas, Malliavin, Thérèse
Formato: Artigo
Idioma:Inglês
Publicado em: BioMed Central 2014
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC4083135/
https://ncbi.nlm.nih.gov/pubmed/25045403
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/1758-2946-6-35
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