Molecular modeling : basic principles and applications / by Hans-Dieter Höltje and Gerd Folkers ; in collaboration with Thomas Beier, Wolfgang Sippl and Didier Rognan.

Format:

Book

Author/Creator:

Höltje, Hans-Dieter.

Contributor:

Folkers, Gerd.

Beier, Thomas

Class of 1924 Book Fund.

Series:

Methods and principles in medicinal chemistry ; v. 5.

Methods and principles in medicinal chemistry ; v. 5

Language:

English

Subjects (All):

Biomolecules--Structure--Computer simulation.

Biomolecules.

Proteins--Structure--Computer simulation.

Proteins.

Molecules--Models--Computer simulation.

Molecules.

Drugs--Design--Computer simulation.

Drugs.

Ligand binding (Biochemistry)--Computer simulation.

Ligand binding (Biochemistry).

Models, Molecular.

Protein Structure.

Drug Design.

Ligands.

Drugs--Design.

Molecules--Models.

Proteins--Structure.

Medical Subjects:

Models, Molecular.

Protein Structure.

Drug Design.

Ligands.

Physical Description:

xii, 194 pages : illustrations (some color) ; 25 cm.

Place of Publication:

Weinheim ; New York : VCH, [1997]

Summary:

Written by experienced experts in molecular modeling, this books describes the basics to the extent that is necessary if one wants to be able to reliably judge the results from molecular modeling calculations. Its main objective is the description of the various pitfalls to be avoided. Without unnecessary overhead it leads the reader from simple calculations on small molecules to the modeling of proteins and other relevant biomolecules. A textbook for beginners as well as an invaluable reference for all those dealing with molecular modeling in their daily work!

Notes:

Includes bibliographical references and index.

Local Notes:

Acquired for the Penn Libraries with assistance from the Class of 1924 Book Fund.

ISBN:

3527293841

OCLC:

38520581