In silico drug discovery and design. ([2013])

• Record Type: Book
• Further Information: Note: Editor, Markus A. Lill.
• Editors: Lill, Markus A
• Other Names: Future Science Ltd., publisher.
• 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.
• Publisher Details: London, England : Future Science Ltd (Unitec House, 2 Albert Place, London N3 1QB, UK)
• Publication Date: 2013
• Extent: 1 PDF (224 pages), color illustrations, digital file
• Subjects: 615/.19; Drug development; Drug development; Drug Discovery -- methods; Electronic books
• Languages: English
• ISBNs: 9781909453012; 1909453013; 9781909453005; 1909453005
• Related ISBNs: 9781909453029
• Notes: Note: Includes bibliographical references and index.; Note: Title from PDF title page (Future Science eBooks Web site, viewed November 18, 2013).
• Access Rights: Legal Deposit; Only available on premises controlled by the deposit library and to one user at any one time; The Legal Deposit Libraries (Non-Print Works) Regulations (UK).
• Access Usage: Restricted: Printing from this resource is governed by The Legal Deposit Libraries (Non-Print Works) Regulations (UK) and UK copyright law currently in force.