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Chapter 15

Predicting Metabolism

Predicting the metabolism of chemicals by computer is as challenging as designing synthesis plans. Programs are described that predict the primary sites of metabolic attack in a query molecule and that predict complete metabolic trees.

Publication details


Print publication date
15 Feb 2019
Copyright year
2019
Print ISBN
978-1-78801-471-7
PDF eISBN
978-1-78801-618-6
ePub eISBN
978-1-78801-742-8