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Large scale study of multiple-molecule queries

BACKGROUND: In ligand-based screening, as well as in other chemoinformatics applications, one seeks to effectively search large repositories of molecules in order to retrieve molecules that are similar typically to a single molecule lead. However, in some case, multiple molecules from the same famil...

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Detalles Bibliográficos
Autores principales: Nasr, Ramzi J, Swamidass, S Joshua, Baldi, Pierre F
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3225883/
https://www.ncbi.nlm.nih.gov/pubmed/20298525
http://dx.doi.org/10.1186/1758-2946-1-7