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Correlation between the structure and skin permeability of compounds
A three-descriptor quantitative structure–activity/toxicity relationship (QSAR/QSTR) model was developed for the skin permeability of a sufficiently large data set consisting of 274 compounds, by applying support vector machine (SVM) together with genetic algorithm. The optimal SVM model possesses t...
Autores principales: | Zeng, Ruolan, Deng, Jiyong, Dang, Limin, Yu, Xinliang |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Nature Publishing Group UK
2021
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8115152/ https://www.ncbi.nlm.nih.gov/pubmed/33980965 http://dx.doi.org/10.1038/s41598-021-89587-5 |
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