In Silico Predictions of the Gastrointestinal Uptake of Macrocycles in Man Using Conformal Prediction Methodology

Authors :: Urban Fagerholm
Sven Hellberg
Jonathan Alvarsson
Ola Spjuth
Source :: Journal of Pharmaceutical Sciences. 111:2614-2619
Publication Year :: 2022
Publisher :: Elsevier BV, 2022.
Abstract: The gastrointestinal uptake of macrocyclic compounds is not fully understood. Here we applied our previously validated integrated system based on machine learning and conformal prediction to predict the passive fraction absorbed (f

Subjects :: Intestinal Absorption
Pharmaceutical Preparations
Solubility
Administration, Oral
Humans
Pharmaceutical Science
Computer Simulation
Caco-2 Cells
Models, Biological
Permeability

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