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Optimal assignment methods for ligand-based virtual screening

BACKGROUND: Ligand-based virtual screening experiments are an important task in the early drug discovery stage. An ambitious aim in each experiment is to disclose active structures based on new scaffolds. To perform these "scaffold-hoppings" for individual problems and targets, a plethora...

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Detalles Bibliográficos
Autores principales: Jahn, Andreas, Hinselmann, Georg, Fechner, Nikolas, Zell, Andreas
Formato: Texto
Lenguaje:English
Publicado: Springer 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2820492/
https://www.ncbi.nlm.nih.gov/pubmed/20150995
http://dx.doi.org/10.1186/1758-2946-1-14