Reactivity‐Based Approaches and Machine Learning Methods for Predicting the Sites of Cytochrome P450‐Mediated Metabolism
Patrik Rydberg · Methods and principles in medicinal chemistry · 2014
This chapter contains sections titled: Introduction Reactivity Models for CYP Reactions Reactivity-Based Methods Applied to CYP-Mediated Site of Metabolism Prediction Machine Learning Methods Applied to CYP-Mediated Site of Metabolism Prediction Applications to SoM Prediction Combinations of Structure-Based Models and Reactivity Conclusions