Review paper
The recent progress in proteochemometric modelling: focusing on target descriptors, cross-term descriptors and application scope
Abstract
As an extension of the conventional quantitative structure activity relationship models, proteochemometric (PCM) modelling is a computational method that can predict the bioactivity relations between multiple ligands and multiple targets. Traditional PCM modelling includes three essential elements: descriptors (including target descriptors, ligand descriptors and cross-term descriptors), bioactivity data and appropriate learning functions that...
Paper Details
Title
The recent progress in proteochemometric modelling: focusing on target descriptors, cross-term descriptors and application scope
Published Date
Feb 11, 2016
Journal
Volume
18
Issue
1
Pages
125 - 136
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