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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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Autors principals: Jahn, Andreas, Hinselmann, Georg, Fechner, Nikolas, Zell, Andreas
Format: Artigo
Idioma:Inglês
Publicat: Springer 2009
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Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC2820492/
https://ncbi.nlm.nih.gov/pubmed/20150995
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/1758-2946-1-14
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