Overview of Computational Toxicology Methods Applied in Drug and Green Chemical Discovery

In the field of computational chemistry, computer models are quickly and cheaply constructed to predict toxicology hazards and results, with no need for test material or animals as these computational predictions are often based on physicochemical properties of chemical structures. Multiple methodol...

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Bibliographic Details
Main Authors: Jose I. Bueso-Bordils, Gerardo M. Antón-Fos, Rafael Martín-Algarra, Pedro A. Alemán-López
Format: Article
Language:English
Published: MDPI AG 2024-12-01
Series:Journal of Xenobiotics
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Online Access:https://www.mdpi.com/2039-4713/14/4/101
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