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Journal of Medicinal Chemistry|June 9, 2006
Refining the multiple protein structure pharmacophore method: consistency across three independent HIV-1 protease modelsKristin L Meagher, Michael G Lerner, Heather A Carlson
Journal of Computer-Aided Molecular Design|August 6, 2008
Automated clustering of probe molecules from solvent mapping of protein surfaces: new algorithms applied to hot-spot mapping and structure-based drug designMichael G Lerner, Kristin L Meagher, Heather A Carlson
Journal of Chemical Information and Modeling|September 20, 2007
Incorporating dynamics in E. coli dihydrofolate reductase enhances structure-based drug discoveryMichael G Lerner, Anna L Bowman, Heather A Carlson
Journal of the American Chemical Society|March 6, 2007
Protein flexibility and species specificity in structure-based drug discovery: dihydrofolate reductase as a test systemAnna L Bowman, Michael G Lerner, Heather A Carlson
The Journal of Chemical Physics|January 3, 2016
Strong influence of periodic boundary conditions on lateral diffusion in lipid bilayer membranesBrian A Camley, Michael G Lerner, Richard W Pastor, et al.
Proteins|June 23, 2005
Binding MOAD (Mother Of All Databases)Liegi Hu, Mark L Benson, Richard D Smith, et al.
Plos Computational Biology|June 27, 2024
Prioritizing drug targets by perturbing biological network response functionsMatthew C Perrone, Michael G Lerner, Matthew Dunworth, et al.
Biophysical Journal|November 4, 2010
Single molecule diffusion of membrane-bound proteins: window into lipid contacts and bilayer dynamicsJefferson D Knight, Michael G Lerner, Joan G Marcano-Velázquez, et al.
Plos Computational Biology|July 25, 2014
Web-based computational chemistry education with CHARMMing II: Coarse-grained protein foldingFrank C Pickard, Benjamin T Miller, Vinushka Schalk, et al.
Journal of the American Chemical Society|September 10, 2014
Determination of biomembrane bending moduli in fully atomistic simulationsZachary A Levine, Richard M Venable, Max C Watson, et al.
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