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Prediction of Human Intestinal Absorption by GA Feature Selection and Support Vector Machine Regression
QSAR (Quantitative Structure Activity Relationships) models for the prediction of human intestinal absorption (HIA) were built with molecular descriptors calculated by ADRIANA.Code, Cerius(2) and a combination of them. A dataset of 552 compounds covering a wide range of current drugs with experiment...
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| Main Authors: | , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Molecular Diversity Preservation International (MDPI)
2008
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2635609/ https://ncbi.nlm.nih.gov/pubmed/19325729 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ijms9101961 |
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