Publications by authors named "Brett A Tounge"

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Inhibitor Bound Dengue NS2B-NS3pro Reveals Multiple Dynamic Binding Modes.
Alan C Gibbs, Ruth Steele, Gaohua Liu, Brett A Tounge, Gaetano T Montelione

Biochemistry· March 2018

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Designing a diverse high-quality library for crystallography-based FBDD screening.
Brett A Tounge, Michael H Parker

Methods Enzymol· June 2011

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Electron density guided fragment-based lead discovery of ketohexokinase inhibitors.
Alan C Gibbs, Marta C Abad, Xuqing Zhang, Brett A Tounge, Francis A Lewandowski

J Med Chem· November 2010

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Hit triage using efficiency indices after screening of compound libraries in drug discovery.
Allen B Reitz, Garry R Smith, Brett A Tounge, Charles H Reynolds

Curr Top Med Chem· September 2010

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Macrocyclic BACE inhibitors: Optimization of a micromolar hit to nanomolar leads.
Yifang Huang, Eric D Strobel, Chih Y Ho, Charles H Reynolds, Kelly A Conway, Brett A Tounge

Bioorg Med Chem Lett· May 2010

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Ligand efficiency and fragment-based drug discovery.
Scott D Bembenek, Brett A Tounge, Charles H Reynolds

Drug Discov Today· March 2009

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Discovery of piperidine carboxamide TRPV1 antagonists.
Wing S Cheung, Raul R Calvo, Brett A Tounge, Sui-Po Zhang, Dennis R Stone

Bioorg Med Chem Lett· August 2008

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Ligand binding efficiency: trends, physical basis, and implications.
Charles H Reynolds, Brett A Tounge, Scott D Bembenek

J Med Chem· April 2008

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Potent, nonpeptide inhibitors of human mast cell tryptase. Synthesis and biological evaluation of novel spirocyclic piperidine amide derivatives.
Michael J Costanzo, Stephen C Yabut, Han-Cheng Zhang, Kimberley B White, Lawrence de Garavilla, Brett A Tounge

Bioorg Med Chem Lett· March 2008

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2-Amino-3,4-dihydroquinazolines as inhibitors of BACE-1 (beta-site APP cleaving enzyme): Use of structure based design to convert a micromolar hit into a nanomolar lead.
Ellen W Baxter, Kelly A Conway, Ludo Kennis, François Bischoff, Marc H Mercken, Brett A Tounge

J Med Chem· September 2007

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The role of molecular size in ligand efficiency.
Charles H Reynolds, Scott D Bembenek, Brett A Tounge

Bioorg Med Chem Lett· August 2007

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Collagen-related peptides: self-assembly of short, single strands into a functional biomaterial of micrometer scale.
Mabel A Cejas, William A Kinney, Cailin Chen, Gregory C Leo, Brett A Tounge

J Am Chem Soc· February 2007

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Synthesis and biological evaluation of type VI beta-turn templated RGD peptidomimetics.
Christopher J Creighton, Yanming Du, Rosemary J Santulli, Brett A Tounge, Allen B Reitz

Bioorg Med Chem Lett· August 2006

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Linear interaction energy models for beta-secretase (BACE) inhibitors: Role of van der Waals, electrostatic, and continuum-solvation terms.
Brett A Tounge, Ramkumar Rajamani, Ellen W Baxter, Allen B Reitz, Charles H Reynolds

J Mol Graph Model· May 2006

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Defining privileged reagents using subsimilarity comparison.
Brett A Tounge, Charles H Reynolds

J Chem Inf Comput Sci· November 2005

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A two-state homology model of the hERG K+ channel: application to ligand binding.
Ramkumar Rajamani, Brett A Tounge, Jian Li, Charles H Reynolds

Bioorg Med Chem Lett· March 2005

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Piperidine-containing beta-arylpropionic acids as potent antagonists of alphavbeta3/alphavbeta5 integrins.
Bart L De Corte, William A Kinney, Li Liu, Shyamali Ghosh, Livia Brunner, Brett A Tounge

Bioorg Med Chem Lett· October 2004

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A Web-based chemoinformatics system for drug discovery.
Scott D Bembenek, Brett A Tounge, Steven J Coats, Charles H Reynolds

Methods Mol Biol· July 2004

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Noncovalent self-assembly of bicyclo[4.2.2]diketopiperazines: influence of saturation in the bridging carbacyclic ring.
Yanming Du, Christopher J Creighton, Brett A Tounge, Allen B Reitz

Org Lett· February 2004

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Calculation of the binding affinity of beta-secretase inhibitors using the linear interaction energy method.
Brett A Tounge, Charles H Reynolds

J Med Chem· May 2003

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Chemical information based scaling of molecular descriptors: a universal chemical scale for library design and analysis.
Brett A Tounge, Lori B Pfahler, Charles H Reynolds

J Chem Inf Comput Sci· September 2002

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