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QSPR Models for Predicting Log P(liver) Values for Volatile Organic Compounds Combining Statistical Methods and Domain Knowledge
Volatile organic compounds (VOCs) are contained in a variety of chemicals that can be found in household products and may have undesirable effects on health. Thereby, it is important to model blood-to-liver partition coefficients (log P(liver)) for VOCs in a fast and inexpensive way. In this paper,...
Autores principales: | Palomba, Damián, Martínez, María J., Ponzoni, Ignacio, Díaz, Mónica F., Vazquez, Gustavo E., Soto, Axel J. |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2012
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268846/ https://www.ncbi.nlm.nih.gov/pubmed/23247367 http://dx.doi.org/10.3390/molecules171214937 |
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