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Current Computer-Aided Drug Design aims to publish all the latest developments in drug design based on computational techniques. The field of computer-aided drug design has had extensive impact in the area of drug design. Current Computer-Aided Drug Design is an essential journal for all medicinal chemists who wish to be kept informed and up-to-date with all the latest and important developments in computer-aided methodologies and their applications in drug discovery. Each issue contains a series of timely, in-depth reviews written by leaders in the field, covering a range of computational techniques for drug design, screening, ADME studies, etc., providing excellent rationales for drug development.

Publisher: Bentham Science Publishers

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Volume 4, Number 3, September 2008

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Articles

Collections of Compounds - How to Deal with them?
pp. 156-168(13)
Authors: Dubois, Julie; Bourg, Stephane; Vrain, Christel; Morin-Allory, Luc

Calculating the Protonation States of Proteins and Small Molecules: Implications to Ligand-Receptor Interactions
pp. 169-179(11)
Authors: Mitra, Rooplekha; Shyam, Radhey; Mitra, Indranil; Miteva, Maria A.; Alexov, Emil

Ligand-Based Approaches in Virtual Screening
pp. 180-190(11)
Author: Douguet, Dominique

ISIDA - Platform for Virtual Screening Based on Fragment and Pharmacophoric Descriptors
pp. 191-198(8)
Authors: Varnek, Alexandre; Fourches, Denis; Horvath, Dragos; Klimchuk, Olga; Gaudin, Cedric; Vayer, Philippe; Solov'ev, Vitaly; Hoonakker, Frank; Tetko, Igor V.; Marcou, Gilles

Pharmacophores of 5-HT4 Receptor Ligands: Experience of CERMN and Implications for Drug Design
pp. 199-208(10)
Authors: Bureau, Ronan; Varin, Thibault; Lepailleur, Alban; Daveu, Cyril; Lemaitre, Stephane; Lancelot, Jean-Charles; Lesnard, Aurelien; Butt-Gueulle, Sabrina; Dauphin, Francois; Rault, Sylvain

How to Measure the Similarity Between Protein Ligand-Binding Sites?
pp. 209-220(12)
Authors: Kellenberger, Esther; Schalon, Claire; Rognan, Didier

Docking and High Throughput Docking: Successes and the Challenge of Protein Flexibility
pp. 221-234(14)
Authors: Cavasotto, Claudio N.; Singh, Narender

Docking and Biomolecular Simulations on Computer Grids: Status and Trends
pp. 235-249(15)
Authors: Tantar, Alexandru-Adrian; Conilleau, Sebastien; Parent, Benjamin; Melab, Nouredine; Brillet, Lorraine; Roy, Sylvaine; Talbi, El-Ghazali; Horvath, Dragos

Combining Ligand- and Structure-Based Methods in Drug Design Projects
pp. 250-258(9)
Authors: Sperandio, Olivier; Miteva, Maria A.; Villoutreix, Bruno O.

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