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Plos Computational Biology|July 14, 2009
Computational fragment-based binding site identification by ligand competitive saturationOlgun Guvench, Alexander D MacKerellCurrent Opinion in Structural Biology|January 24, 2009
Computational evaluation of protein-small molecule bindingOlgun Guvench, Alexander D MacKerellMethods in Molecular Biology (Clifton, N.J.)|May 1, 2008
Comparison of protein force fields for molecular dynamics simulationsOlgun Guvench, Alexander D MacKerellJournal of Molecular Modeling|May 7, 2008
Automated conformational energy fitting for force-field developmentOlgun Guvench, Alexander D MacKerellThe Journal of Physical Chemistry. A|August 11, 2006
Quantum mechanical analysis of 1,2-ethanediol conformational energetics and hydrogen bondingOlgun Guvench, Alexander D MackerellThe Journal of Physical Chemistry. B|August 22, 2009
CHARMM additive all-atom force field for aldopentofuranoses, methyl-aldopentofuranosides, and fructofuranoseElizabeth Hatcher, Olgun Guvench, Alexander D MackerellCurrent Pharmaceutical Design|August 17, 2013
Molecular mechanicsKenno Vanommeslaeghe, Olgun Guvench, Alexander D MacKerellJournal of Chemical Theory and Computation|February 18, 2010
CHARMM Additive All-Atom Force Field for Acyclic Polyalcohols, Acyclic Carbohydrates and InositolElizabeth Hatcher, Olgun Guvench, Alexander D MackerellJournal of Computational Chemistry|May 30, 2012
Balancing target flexibility and target denaturation in computational fragment-based inhibitor discoveryTheresa J Foster, Alexander D MacKerell, Olgun GuvenchThe Journal of Physical Chemistry. B|September 18, 2010
CHARMM additive all-atom force field for glycosidic linkages in carbohydrates involving furanosesE Prabhu Raman, Olgun Guvench, Alexander D MacKerellPageof 43