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QSAR Development for Plasma Protein Binding: Influence of the Ionization State
PURPOSE: This study explored several strategies to improve the performance of literature QSAR models for plasma protein binding (PPB), such as a suitable endpoint transformation, a correct representation of chemicals, more consistency in the dataset, and a reliable definition of the applicability do...
Autores principales: | , , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Springer US
2018
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6308215/ https://www.ncbi.nlm.nih.gov/pubmed/30591975 http://dx.doi.org/10.1007/s11095-018-2561-8 |