Natural product-likeness score revisited: an open-source, open-data implementation

BACKGROUND: Natural product-likeness of a molecule, i.e. similarity of this molecule to the structure space covered by natural products, is a useful criterion in screening compound libraries and in designing new lead compounds. A closed source implementation of a natural product-likeness score, that...

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Detalles Bibliográficos
Autores principales: Jayaseelan, Kalai Vanii, Moreno, Pablo, Truszkowski, Andreas, Ertl, Peter, Steinbeck, Christoph
Formato: Online Artículo Texto
Lenguaje:English
Publicado: BioMed Central 2012
Materias:
Methodology Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3436723/
https://www.ncbi.nlm.nih.gov/pubmed/22607271
http://dx.doi.org/10.1186/1471-2105-13-106

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3436723/
https://www.ncbi.nlm.nih.gov/pubmed/22607271
http://dx.doi.org/10.1186/1471-2105-13-106

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