Drug Design Strategies: Computational Techniques and Applications
Author:   Lee Banting (University of Portsmouth, UK) ,  Tim Clark (Universität Erlangen-Nürnberg, Germany) ,  David E. Thurston ,  Rob J. Deeth
Publisher:   Royal Society of Chemistry
Volume:   Volume 20
ISBN:  

9781849731676


Pages:   239
Publication Date:   18 January 2012
Format:   Hardback
Availability:   In Print   Availability explained
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Drug Design Strategies: Computational Techniques and Applications


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Author:   Lee Banting (University of Portsmouth, UK) ,  Tim Clark (Universität Erlangen-Nürnberg, Germany) ,  David E. Thurston ,  Rob J. Deeth
Publisher:   Royal Society of Chemistry
Imprint:   Royal Society of Chemistry
Volume:   Volume 20
Dimensions:   Width: 15.60cm , Height: 2.30cm , Length: 23.40cm
Weight:   0.530kg
ISBN:  

9781849731676


ISBN 10:   1849731675
Pages:   239
Publication Date:   18 January 2012
Audience:   Professional and scholarly ,  Professional & Vocational
Format:   Hardback
Publisher's Status:   Active
Availability:   In Print   Availability explained
This item will be ordered in for you from one of our suppliers. Upon receipt, we will promptly dispatch it out to you. For in store availability, please contact us.

Table of Contents

Introduction; Quantum Mechanical/Molecular Mechanical Approaches in Drug Design; Transition Metal Systems; Modeling Protein-Protein Interactions by Rigid-body Docking; QM Based Modelling; Semi-empirical Methods: Current Status and Future Directions; Quantum Chemical Topology: on Descriptors, Potentials and Fragments; Cheminformatics in Diverse Dimensions; Analysing Molecular Surface Properties; Atomistic Modelling of Drug Delivery Systems; Index

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Author Information

Dr Lee Banting BSc(Hons) PhD MRSC CChem, is at the Centre of Molecular Design, School of Pharmacy and Biomedical Sciences, University of Portsmouth, UK. He is a Senior Lecturer in Medicinal Chemistry and is on the Editorial Board of Natural Product Communications. Prof Dr Tim Clark is Professor in Computational Chemistry, and Head of the Centre of Molecular Design, School of Pharmacy and Biomedical Sciences, University of Portsmouth, UK and Technical Director, Computer-Chemie-Centrum, Universitat Erlangen-Nurnberg, Germany and Editor-in-Chief of the Journal of Molecular Modelling.

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