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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...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
BioMed Central
2012
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Materias: | |
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 |