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Automated compound classification using a chemical ontology

BACKGROUND: Classification of chemical compounds into compound classes by using structure derived descriptors is a well-established method to aid the evaluation and abstraction of compound properties in chemical compound databases. MeSH and recently ChEBI are examples of chemical ontologies that pro...

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Detalles Bibliográficos
Autores principales:	Bobach, Claudia, Böhme, Timo, Laube, Ulf, Püschel, Anett, Weber, Lutz
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	BioMed Central 2012
Materias:	Research Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3547776/ https://www.ncbi.nlm.nih.gov/pubmed/23273256 http://dx.doi.org/10.1186/1758-2946-4-40

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