Search Result "molecular docking"


The Molecular Basis of COX-2 Versus COX-1 Selectivity of Lumiracoxib by Molecular Docking Studies

Journal: Letters in Drug Design & Discovery
Volume: 4 Issue: 6 Year: 2007 Page: 422-425
Author(s): Celia M. Correa, Andre F. de Paula, Gilberto M.S. da Silva, Carlos M.R. SantAnna, Carlos A. M. Fraga, Eliezer J. Barreiro

Processing of Small Molecule Databases for Automated Docking

Journal: Medicinal Chemistry
Volume: 3 Issue: 1 Year: 2007 Page: 107-113
Author(s): Maxwell D. Cummings, Alan C. Maxwell, Renee L. DesJarlais

Structure-Based Drug Design: Docking and Scoring

Journal: Current Protein & Peptide Science
Volume: 8 Issue: 4 Year: 2007 Page: 312-328
Author(s): Romano T. Kroemer

Molecular Modelling and QSAR in the Discovery of HIV-1 Integrase Inhibitors

Journal: Current Computer-Aided Drug Design
Volume: 3 Issue: 3 Year: 2007 Page: 214-233
Author(s): Anna M. Almerico, Marco Tutone, Mario Ippolito, Antonino Lauria

Ligand Docking and Structure-based Virtual Screening in Drug Discovery

Journal: Current Topics in Medicinal Chemistry
Volume: 7 Issue: 1 Year: 2007 Page: 1006-1014
Author(s): Claudio N. Cavasotto, Andrew J. W. Orry

Molecular Modeling Databases: A New Way in the Search of Protein Targets for Drug Development

Journal: Current Bioinformatics
Volume: 2 Issue: 1 Year: 2007 Page: 1-10
Author(s): Nelson Jose Freitas da Silveira, Carlos Eduardo Bonalumi, Helen Andrade Arcuri, Walter Filgueira de Azevedo Junior

ParDOCK: An All Atom Energy Based Monte Carlo Docking Protocol for Protein-Ligand Complexes

Journal: Protein & Peptide Letters
Volume: 14 Issue: 7 Year: 2007 Page: 632-646
Author(s): A. Gupta, A. Gandhimathi, P. Sharma, B. Jayaram

Molecular Lipophilicity in Protein Modeling and Drug Design

Journal: Current Medicinal Chemistry
Volume: 14 Issue: 4 Year: 2007 Page: 393-415
Author(s): Roman G. Efremov, Anton O. Chugunov, Timothy V. Pyrkov, John P. Priestle, Alexander S. Arseniev, Edgar Jacoby

Molecular Simulations of Rhodopsin Tetrameter

Journal: Protein & Peptide Letters
Volume: 14 Issue: 4 Year: 2007 Page: 381-387
Author(s): M. Witt, J. Ciarkowski, C. Czaplewski

Structure Based Drug Design for HIV Protease: From Molecular Modeling to Cheminformatics

Journal: Current Topics in Medicinal Chemistry
Volume: 7 Issue: 1 Year: 2007 Page: 1030-1038
Author(s): Patra Volarath, Robert W. Harrison, Irene T. Weber

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