Prediction of ADME properties, Part 1: Classification models to predict Caco-2 cell permeability using atom-based bilinear indices

The prediction of the permeability through cultured Caco-2 cells (an often-used in vitro model for drug absorption) is carried out using theoretical models. Atom-based bilinear indices and linear discriminant analysis (LDA) are used to obtain quantitative models, which discriminate between higher ab...

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Veröffentlicht in:	Afinidad 2014, Vol.71 (566)
Hauptverfasser:	Castillo-Garit, Juan, Cañizares-Carmenate, Yudith, Marrero-Ponce, Yovani, Abad, Concepción, Torrens, Francisco
Format:	Artikel
Sprache:	cat ; eng
Online-Zugang:	Volltext
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