BioDrugScreen: a computational drug design resource for ranking molecules docked to the human proteome

BioDrugScreen is a resource for ranking molecules docked against a large number of targets in the human proteome. Nearly 1600 molecules from the freely available NCI diversity set were docked onto 1926 cavities identified on 1589 human targets resulting in >3 million receptor–ligand complexes req...

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Detalles Bibliográficos
Autores principales: Li, Liwei, Bum-Erdene, Khuchtumur, Baenziger, Peter H., Rosen, Joshua J., Hemmert, Jamison R., Nellis, Joy A., Pierce, Marlon E., Meroueh, Samy O.
Formato: Texto
Lenguaje:English
Publicado: Oxford University Press 2010
Materias:
Articles
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2808957/
https://www.ncbi.nlm.nih.gov/pubmed/19923229
http://dx.doi.org/10.1093/nar/gkp852

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2808957/
https://www.ncbi.nlm.nih.gov/pubmed/19923229
http://dx.doi.org/10.1093/nar/gkp852

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