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Enrico O Purisima

Showing results (1-10 of 65) with videos related to

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Methods in Molecular Biology (Clifton, N.J.)|December 21, 2011
The solvated interaction energy method for scoring binding affinitiesTraian Sulea, Enrico O Purisima
The Journal of Physical Chemistry. B|May 23, 2009
Restoring charge asymmetry in continuum electrostatics calculations of hydration free energiesEnrico O Purisima, Traian Sulea
Biophysical Journal|April 30, 2003
Profiling charge complementarity and selectivity for binding at the protein surfaceTraian Sulea, Enrico O Purisima
Current Pharmaceutical Design|August 17, 2013
Solvation models: theory and validationEnrico O Purisima, Traian Sulea
The Journal of Physical Chemistry. B|March 22, 2012
Protein-ligand binding free energies from exhaustive dockingEnrico O Purisima, Hervé Hogues
Journal of Computational Chemistry|April 12, 2002
A fast pairwise evaluation of molecular surface areaVladislav Vasilyev, Enrico O Purisima
Proteins|November 16, 2005
Molecular surface generation using a variable-radius solvent probeSathesh Bhat, Enrico O Purisima
Journal of Computer-Aided Molecular Design|December 23, 2011
Predicting hydration free energies of polychlorinated aromatic compounds from the SAMPL-3 data set with FiSH and LIE modelsTraian Sulea, Enrico O Purisima
Journal of Chemical Information and Modeling|August 19, 2015
Evaluation of the Wilma-SIE Virtual Screening Method in Community Structure-Activity Resource 2013 and 2014 Blind ChallengesHervé Hogues, Traian Sulea, Enrico O Purisima
Journal of Computational Chemistry|September 22, 2006
Coupled atomic charge selectivity for optimal ligand-charge distributions at protein binding sitesSathesh Bhat, Traian Sulea, Enrico O Purisima
Pageof 7

Showing results (1-10 of 65) with videos related to

Sort By:
Pageof 7
Methods in Molecular Biology (Clifton, N.J.)|December 21, 2011
The solvated interaction energy method for scoring binding affinitiesTraian Sulea, Enrico O Purisima
The Journal of Physical Chemistry. B|May 23, 2009
Restoring charge asymmetry in continuum electrostatics calculations of hydration free energiesEnrico O Purisima, Traian Sulea
Biophysical Journal|April 30, 2003
Profiling charge complementarity and selectivity for binding at the protein surfaceTraian Sulea, Enrico O Purisima
Current Pharmaceutical Design|August 17, 2013
Solvation models: theory and validationEnrico O Purisima, Traian Sulea
The Journal of Physical Chemistry. B|March 22, 2012
Protein-ligand binding free energies from exhaustive dockingEnrico O Purisima, Hervé Hogues
Journal of Computational Chemistry|April 12, 2002
A fast pairwise evaluation of molecular surface areaVladislav Vasilyev, Enrico O Purisima
Proteins|November 16, 2005
Molecular surface generation using a variable-radius solvent probeSathesh Bhat, Enrico O Purisima
Journal of Computer-Aided Molecular Design|December 23, 2011
Predicting hydration free energies of polychlorinated aromatic compounds from the SAMPL-3 data set with FiSH and LIE modelsTraian Sulea, Enrico O Purisima
Journal of Chemical Information and Modeling|August 19, 2015
Evaluation of the Wilma-SIE Virtual Screening Method in Community Structure-Activity Resource 2013 and 2014 Blind ChallengesHervé Hogues, Traian Sulea, Enrico O Purisima
Journal of Computational Chemistry|September 22, 2006
Coupled atomic charge selectivity for optimal ligand-charge distributions at protein binding sitesSathesh Bhat, Traian Sulea, Enrico O Purisima
Pageof 7