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Molecular modeling : basic principles and applications / Hans-Dieter Höltje ... [et al.].

Contributor(s): Höltje, Hans-Dieter.
Publisher: Weinheim : Wiley-VCH, c2008Edition: 3rd, rev. and expanded ed.Description: x, 310 p. : ill. (some col.) ; 24 cm.ISBN: 9783527315680 (pbk.); 3527315683 (pbk.).Subject(s): Biomolecules -- Structure -- Computer simulation | Proteins -- Structure -- Computer simulation | Molecules -- Models -- Computer simulation | Drugs -- Design -- Computer simulation | Ligand binding (Biochemistry) -- Computer simulationDDC classification: 572.330113
Contents:
Introduction -- Small molecules -- A case study for small molecule modeling: dopamine Db3s, receptor antagonists -- Introduction to comparative protein modeling -- Virtual screening and docking -- Scope and limits of molecular docking -- Chemogenomic approaches to rational drug design -- A case study for protein modeling: the nuclear hormone receptor CAR as an example for comparative modeling and the analysis of protein-ligand complexes.
Item type Current location Call number Copy number Status Notes Date due Barcode
SOM Main Collection Clinical School
572.330113 MOL 2008 (Browse shelf) 1 Available SOMxx,33001,03,CL 5000113844

Includes bibliographical references and index.

Introduction -- Small molecules -- A case study for small molecule modeling: dopamine Db3s, receptor antagonists -- Introduction to comparative protein modeling -- Virtual screening and docking -- Scope and limits of molecular docking -- Chemogenomic approaches to rational drug design -- A case study for protein modeling: the nuclear hormone receptor CAR as an example for comparative modeling and the analysis of protein-ligand complexes.