Published Work
In silico drug discovery and design
- Editor
- Lill, Markus A.
- ISBN
- 9781909453012 (eISBN)
- 9781909453029 (print)
- 9781909453005 (ePub)
- 2047-332X
- Place of publication
- London
- Publisher
- Publication date
- 2013
- Pages
- 224 pages
- Illustrations
- colour illustrations
- Series
- Future Science Group eBook collection
- Contents
- In silico drug discovery and design / Markus A. Lill -- Molecular docking and structure-based virtual screening / Chenzhong Liao, Megan L. Peach, Risheng Yao & Marc C Nicklaus -- Computational fragment-based drug design / Gregory Sliwoski & Edward W. Lowe Jr. -- Comparative modeling and structure prediction : application to drug discovery / Emidio Capriotti -- Advances in molecular dynamics simulations and free-energy calculations relevant for drug design / Nadine Homeyer & Holger Gohlke -- Quantum mechanical applications in drug discovery / Michael P. Mazanetz -- Pharmacophore modeling / Stefan M. Noha & Daniela Schuster -- QSAR in the new millennium / Vijay M. Khedkar & Evans C. Coutinho -- Receptor-dependent QSAR methods / Xialan Dong & Weifan Zheng -- Computational methods based on molecular shape / Elisabet Gregori-Puigjané -- Machine learning and similarity-based virtual screening techniques / Jürgen Bajorath -- In silico absorption, distribution, metabolism and excretion / Prashant S. Kharkar -- Computational models for toxicity prediction / Sandhya Kortagere -- Computational methods for drug target profiling and polypharmacology / Thierry Langer & Sharon D. Bryant -- Integrating structure-and ligand-based approaches for computer-aided drug design / Gregory L. Wilson & Markus A. Lill -- Binding site identification in target proteins / Yi Xiong, Xiaolei Zhu & Daisuke Kihara -- Index.
- Note
- Includes bibliographical references and index.
- Access restricted to staff and registered students of the University of Strathclyde
- Subject
- Resource Type
- Former identifier
- 10.4155/9781909453012
- 9913055945302996
Relations
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