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Multiple search methods for similarity-based virtual screening: analysis of search overlap and precision
BACKGROUND: Data fusion methods are widely used in virtual screening, and make the implicit assumption that the more often a molecule is retrieved in multiple similarity searches, the more likely it is to be active. This paper tests the correctness of this assumption. RESULTS: Sets of 25 searches us...
Autores principales: | Holliday, John D, Kanoulas, Evangelos, Malim, Nurul, Willett, Peter |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
BioMed Central
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3195112/ https://www.ncbi.nlm.nih.gov/pubmed/21824430 http://dx.doi.org/10.1186/1758-2946-3-29 |
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