Publications

Parai MKumar, Huggins DJ, Cao H, Nalam MNL, Ali A, Schiffer CA, Tidor B, Rana TM.  2012.  Design, synthesis, and biological and structural evaluations of novel HIV-1 protease inhibitors to combat drug resistance.. J Med Chem. 55(14):6328-41.

Huggins DJ, Sherman W, Tidor B.  2012.  Rational approaches to improving selectivity in drug design.. J Med Chem. 55(4):1424-44.

Huggins DJ, Venkitaraman AR, Spring DR.  2011.  Rational methods for the selection of diverse screening compounds.. ACS Chem Biol. 6(3):208-17.

Huggins DJ, Tidor B.  2011.  Systematic placement of structural water molecules for improved scoring of protein-ligand interactions.. Protein Eng Des Sel. 24(10):777-89.

Huggins DJ, Marsh M, Payne MC.  2011.  Thermodynamic Properties of Water Molecules at a Protein-Protein Interaction Surface.. J Chem Theory Comput. 7(11):3514-3522.

Huggins DJ, McKenzie GJ, Robinson DD, Narváez AJ, Hardwick B, Roberts-Thomson M, Venkitaraman AR, Grant GH, Payne MC.  2010.  Computational analysis of phosphopeptide binding to the polo-box domain of the mitotic kinase PLK1 using molecular dynamics simulation.. PLoS Comput Biol. 6(8)

Huggins DJ, Altman MD, Tidor B.  2009.  Evaluation of an inverse molecular design algorithm in a model binding site.. Proteins. 75(1):168-86.

Cusson M, Béliveau C, Sen SE, Vandermoten S, Rutledge RG, Stewart D, Francis F, Haubruge E, Rehse P, Huggins DJ et al..  2006.  Characterization and tissue-specific expression of two lepidopteran farnesyl diphosphate synthase homologs: implications for the biosynthesis of ethyl-substituted juvenile hormones.. Proteins. 65(3):742-58.

Huggins DJ, Grant GH.  2005.  The function of the amino terminal domain in NMDA receptor modulation.. J Mol Graph Model. 23(4):381-8.

Dubos C, Willment J, Huggins D, Grant GH, Campbell MM.  2005.  Kanamycin reveals the role played by glutamate receptors in shaping plant resource allocation.. Plant J. 43(3):348-55.

Dubos C, Huggins D, Grant GH, Knight MR, Campbell MM.  2003.  A role for glycine in the gating of plant NMDA-like receptors.. Plant J. 35(6):800-10.