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A comparative study on the molecular descriptors for predicting drug-likeness of small molecules

Screening of “ drug-like” molecule from the molecular database produced through high throughput techniques and their large repositories requires robust classification. In our work, a set of heuristically chosen nine molecular descriptors including four from Lipinski's rule, were used as classif...

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Detalles Bibliográficos
Autores principales: Mishra, Hrishikesh, Singh, Nitya, Lahiri, Tapobrata, Misra, Krishna
Formato: Texto
Lenguaje:English
Publicado: Biomedical Informatics Publishing Group 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2728118/
https://www.ncbi.nlm.nih.gov/pubmed/19707563