New developments on the cheminformatics open workflow environment CDK-Taverna

BACKGROUND: The computational processing and analysis of small molecules is at heart of cheminformatics and structural bioinformatics and their application in e.g. metabolomics or drug discovery. Pipelining or workflow tools allow for the Lego™-like, graphical assembly of I/O modules and algorithms...

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Detalles Bibliográficos
Autores principales: Truszkowski, Andreas, Jayaseelan, Kalai Vanii, Neumann, Stefan, Willighagen, Egon L, Zielesny, Achim, Steinbeck, Christoph
Formato: Online Artículo Texto
Lenguaje:English
Publicado: BioMed Central 2011
Materias:
Software
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3292505/
https://www.ncbi.nlm.nih.gov/pubmed/22166170
http://dx.doi.org/10.1186/1758-2946-3-54

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3292505/
https://www.ncbi.nlm.nih.gov/pubmed/22166170
http://dx.doi.org/10.1186/1758-2946-3-54

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