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Modeling skin sensitization potential of mechanistically hard-to-be-classified aniline and phenol compounds with quantum mechanistic properties

BACKGROUND: Advanced structure-activity relationship (SAR) modeling can be used as an alternative tool for identification of skin sensitizers and in improvement of the medical diagnosis and more effective practical measures to reduce the causative chemical exposures. It can also circumvent ethical c...

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Detalles Bibliográficos
Autores principales: Ouyang, Qin, Wang, Lirong, Mu, Ying, Xie, Xiang-Qun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: BioMed Central 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4298069/
https://www.ncbi.nlm.nih.gov/pubmed/25539579
http://dx.doi.org/10.1186/2050-6511-15-76