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Connecting proteins with drug-like compounds: Open source drug discovery workflows with BindingDB and KNIME

Today’s large, public databases of protein–small molecule interaction data are creating important new opportunities for data mining and integration. At the same time, new graphical user interface-based workflow tools offer facile alternatives to custom scripting for informatics and data analysis. He...

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Detalles Bibliográficos
Autores principales:	Nicola, George, Berthold, Michael R., Hedrick, Michael P., Gilson, Michael K.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Oxford University Press 2015
Materias:	Original Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4572361/ https://www.ncbi.nlm.nih.gov/pubmed/26384374 http://dx.doi.org/10.1093/database/bav087

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