Molecular modeling : basic principles and applications / Hans-Dieter H�oltje ... [et al.]. - 3rd, rev. and expanded ed. - Weinheim : Wiley-VCH, c2008. - x, 310 p. : ill. (some col.) ; 24 cm.

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

3527315683 (pbk. : acid-free paper) 9783527315680 (pbk. : acid-free paper)

2008531099

GBA767082 bnb

013824572 Uk


Biomolecules--Structure--Computer simulation.
Drugs--Design--Computer simulation.
Ligand binding (Biochemistry)--Computer simulation.
Molecules--Models--Computer simulation.
Proteins--Structure--Computer simulation.

QP517. / M63-2008

572/.330113

QP517.M3 / M64 2008