IngentaConnect Search Results

Molecular Recognition and Drug-Lead Identification: What Can Molecular Simulations Tell Us?

Authors: Morra, G.; Genoni, A.; Neves, M. A.C.; Merz Jr., K. M.; Colombo, G.

Source: Current Medicinal Chemistry, Volume 17, Number 1, January 2010 , pp. 25-41(17)

Publisher: Bentham Science Publishers

Structure-based Drug Metabolism Predictions for Drug Design

Authors: Sun, Hao; Scott, Dennis O.

Source: Chemical Biology & Drug Design, Volume 75, Number 1, January 2010 , pp. 3-17(15)

Publisher: Blackwell Publishing

Fragment-Based Cocktail Crystallography by the Medical Structural Genomics of Pathogenic Protozoa Consortium

Authors: Verlinde, Christophe L.M.J.; Fan, Erkang; Shibata, Sayaka; Zhang, Zhongsheng; Sun, Zhihua; Deng, Wei; Ross, Jennifer; Kim, Jessica; Xiao, Liren; Arakaki, Tracy L.; Bosch, Jurgen; Caruthers, Jonathan M.; Larson, Eric T.; LeTrong, Isolde; Napuli, Alberto; Kelley, Angela; Mueller, Natasha; Zucker, Frank; Van Voorhis, Wesley C.; Buckner, Frederick S.; Merritt, Ethan A.; Hol, Wim G.J.

Source: Current Topics in Medicinal Chemistry, Volume 9, Number 18, December 2009 , pp. 1678-1687(10)

Publisher: Bentham Science Publishers

Rational ligand-based virtual screening and structure-activity relationship studies in the ligand-binding domain of the glucocorticoid receptor-α

Authors: Onnis, Valeria; Kinsella, Gemma K; Carta, Giorgio; Fayne, Darren; Lloyd, David G

Source: Future Medicinal Chemistry, Volume 1, Number 3, June 2009 , pp. 483-499(17)

Publisher: Future Science

Overview of computational methods employed in early-stage drug discovery

Authors: Skjevik, Åge Aleksander; Teigen, Knut; Martinez, Aurora

Source: Future Medicinal Chemistry, Volume 1, Number 1, April 2009 , pp. 49-63(15)

Publisher: Future Science

Protein Structure Prediction in Structure-Based Ligand Design and Virtual Screening

Author: Grant, Marianne A.

Source: Combinatorial Chemistry & High Throughput Screening, Volume 12, Number 10, December 2009 , pp. 940-960(21)

Publisher: Bentham Science Publishers

Structure-Based Virtual Ligand Screening: Recent Success Stories

Authors: Villoutreix, Bruno O.; Eudes, Richard; Miteva, Maria A.

Source: Combinatorial Chemistry & High Throughput Screening, Volume 12, Number 10, December 2009 , pp. 1000-1016(17)

Publisher: Bentham Science Publishers

Editorial [Hot topic: In Silico Approaches in G Protein-Coupled Receptors (GPCRs) Drug Discovery: Quo Vadis? (Executive Editor: Stefano Moro)]

Author: Moro, Stefano

Source: Current Pharmaceutical Design, Volume 15, Number 35, December 2009 , pp. 3992-3993(2)

Publisher: Bentham Science Publishers

Customizing G Protein-Coupled Receptor Models for Structure-Based Virtual Screening

Authors: de Graaf, Chris; Rognan, Didier

Source: Current Pharmaceutical Design, Volume 15, Number 35, December 2009 , pp. 4026-4048(23)

Publisher: Bentham Science Publishers

G Protein-Coupled Receptors: Target-Based In Silico Screening

Authors: Senderowitz, Hanoch; Marantz, Yael

Source: Current Pharmaceutical Design, Volume 15, Number 35, December 2009 , pp. 4049-4068(20)

Publisher: Bentham Science Publishers

Inhibitors of HMG-CoA Reductase: Current and Future Prospects

Authors: Singh, Narender; Tamariz, Joaquin; Chamorro, German; Medina-Franco, Jose L.

Source: Mini Reviews in Medicinal Chemistry, Volume 9, Number 11, October 2009 , pp. 1272-1283(12)

Publisher: Bentham Science Publishers

Editorial [Hot topic: Inhibition and Function of Heat Shock Proteins 70 and 90 (Guest Editor: Brian S. J. Blagg)]

Author: Blagg, Brian S.J.

Source: Current Topics in Medicinal Chemistry, Volume 9, Number 15, November 2009 , pp. 1335-1336(2)

Publisher: Bentham Science Publishers

Structural and Computational Biology of the Molecular Chaperone Hsp90: From Understanding Molecular Mechanisms to Computer-Based Inhibitor Design

Authors: Verkhivker, Gennady M.; Dixit, Anshuman; Morra, Giulia; Colombo, Giorgio

Source: Current Topics in Medicinal Chemistry, Volume 9, Number 15, November 2009 , pp. 1369-1385(17)

Publisher: Bentham Science Publishers

Rational structure-based drug design and optimization in the ligand-binding domain of the glucocorticoid receptor-α

Authors: Onnis, Valeria; Kinsella, Gemma K; Carta, Giorgio; Fayne, Darren; Lloyd, David G

Source: Future Medicinal Chemistry, Volume 1, Number 2, May 2009 , pp. 345-359(15)

Publisher: Future Science

Relieving the first bottleneck in the drug discovery pipeline: using array technologies to rationalize membrane protein production

Authors: Bonander, Nicklas; Bill, Roslyn M

Source: Expert Review of Proteomics, Volume 6, Number 5, October 2009 , pp. 501-505(5)

Publisher: Expert Reviews

Dimethylthiazolidine Carboxylic Acid as a Rigid P3 Unit in Inhibitors of Serine Proteases: Application to Two Targets

Authors: Kawai, Stephen H.; Aubry, Norman; Duceppe, Jean-Simon; Llinàs-Brunet, Montse; LaPlante, Steven R.

Source: Chemical Biology & Drug Design, Volume 74, Number 5, November 2009 , pp. 517-522(6)

Publisher: Blackwell Publishing

Analysis of c-Met Kinase Domain Complexes: A New Specific Catalytic Site Receptor Model for Defining Binding Modes of ATP-Competitive Ligands

Authors: Asses, Yasmine; Leroux, Vincent; Tairi-Kellou, Safia; Dono, Rosanna; Maina, Flavio; Maigret, Bernard

Source: Chemical Biology & Drug Design, Volume 74, Number 6, December 2009 , pp. 560-570(11)

Publisher: Blackwell Publishing

Rationalizing Protein-Ligand Interactions for PTP1B Inhibitors Using Computational Methods

Authors: Ajmani, Subhash; Karanam, Sudheer; Kulkarni, Sudhir A.

Source: Chemical Biology & Drug Design, Volume 74, Number 6, December 2009 , pp. 582-595(14)

Publisher: Blackwell Publishing

Subtype-selective targeting of voltage-gated sodium channels

Authors: England, Steve; de Groot, Marcel J

Source: British Journal of Pharmacology, Volume 158, Number 6, November 2009 , pp. 1413-1425(13)

Publisher: Blackwell Publishing

Calmodulin in Complex with Proteins and Small Molecule Ligands: Operating with the Element of Surprise; Implications for Structure-Based Drug Design

Authors: Menyhard, Dora K.; Keseru, Gyorgy M.; Naray-Szabo, Gabor

Source: Current Computer - Aided Drug Design, Volume 5, Number 4, December 2009 , pp. 264-279(16)

Publisher: Bentham Science Publishers