KNIME-CDK: Workflow-driven cheminformatics

BACKGROUND: Cheminformaticians have to routinely process and analyse libraries of small molecules. Among other things, that includes the standardization of molecules, calculation of various descriptors, visualisation of molecular structures, and downstream analysis. For this purpose, scientific work...

Descripció completa

Guardat en:
Dades bibliogràfiques
Autors principals: Beisken, Stephan, Meinl, Thorsten, Wiswedel, Bernd, de Figueiredo, Luis F, Berthold, Michael, Steinbeck, Christoph
Format: Artigo
Idioma:Inglês
Publicat: BioMed Central 2013
Matèries:
Software
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC3765822/
https://ncbi.nlm.nih.gov/pubmed/24103053
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/1471-2105-14-257
Etiquetes: Afegir etiqueta
Sense etiquetes, Sigues el primer a etiquetar aquest registre!

Ítems similars