In Silico Methods for Predicting Drug Toxicity (e-book) (used book) | bookbook.eu

Description

1. QSAR Methods

Giuseppina Gini

Part I: Modeling a Pharmaceutical in the Human Body

2. In Silico 3D-Modelling of Binding Activities

Stefano Moro, Mattia Sturlese, Antonella Ciancetta, and Matteo Floris

3. Modeling Pharmacokinetics

Frederic Y. Bois and Céline Brochot

4. Modeling ADMET

Jayeeta Ghosh, Michael S. Lawless, Marvin Waldman, Vijay Gombar, and Robert Fraczkiewicz

Part II: The Applications of In Silico Models for the Different Endpoints

5. In Silico Prediction of Chemically-Induced Mutagenicity: How to Use QSAR Models and Interpret Their Results

6. In Silico Methods for Carcinogenicity Assessment

Azadi Golbamaki and Emilio Benfenati

7. VirtualToxLab: Exploring the Toxic Potential of Rejuvenating Substances Found in Traditional Medicines

Martin Smiesko and Angelo Vedani

8. In Silico Model for Developmental Toxicity: How to Use QSAR Models and Interpret Their Results

Marco Marzo, Alessandra Roncaglioni, Sunil Kulkarni, Tara S. Barton-Maclaren, and Emilio Benfenati

9. In Silico Models for Repeated Dose Toxicity (RDT): Prediction of the No Observed Adverse Effect Level (NOAEL) and Lowest Observed Adverse Effect Level (LOAEL) for Drugs

Fabiola Pizzo and Emilio Benfenati

10. In Silico Models for Acute Systemic Toxicity

Julien Burton, Andrew P. Worth, Ivanka Tsakovska, and Antonia Diukendjieva

11. In Silico Models for Hepatotoxicity

Mark Hewitt and Katarzyna Przybylak

12. In Silico Models for Ecotoxicity of Pharmaceuticals

Kunal Roy and Supratik Kar

Serena Manganelli and Emilio Benfenati

Part III: The Scientific and Society Challenges

14. Adverse Outcome Pathways as Tools to Assess Drug-Induced Toxicity

Mathieu Vinken

15. A Systems Biology Approach for Identifying Hepatotoxicant Groups Based on Similarity in Mechanisms of Action and Chemical Structure

16. In Silico Study of In Vitro GPCR Assays by QSAR Modeling

Kamel Mansouri and Richard S. Judson

17. Taking Advantage of Databases

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