A New Graph-Based Molecular Descriptor Using the Canonical Representation of the Molecule

Molecular similarity is a pervasive concept in drug design. The basic idea underlying molecular similarity is the similar property principle, which states that structurally similar molecules will exhibit similar physicochemical and biological properties. In this paper, a new graph-based molecular de...

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Detalles Bibliográficos
Autores principales: Hentabli, Hamza, Saeed, Faisal, Abdo, Ammar, Salim, Naomie
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Hindawi Publishing Corporation 2014
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4130360/
https://www.ncbi.nlm.nih.gov/pubmed/25140330
http://dx.doi.org/10.1155/2014/286974

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4130360/
https://www.ncbi.nlm.nih.gov/pubmed/25140330
http://dx.doi.org/10.1155/2014/286974

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