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Jonathan W Essex

Showing results (1-10 of 105) with videos related to

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Plos One|December 24, 2011
The ELBA force field for coarse-grain modeling of lipid membranesMario Orsi, Jonathan W Essex
Faraday Discussions|June 29, 2013
Physical properties of mixed bilayers containing lamellar and nonlamellar lipids: insights from coarse-grain molecular dynamics simulationsMario Orsi, Jonathan W Essex
Journal of Computer-Aided Molecular Design|July 28, 2016
All-atom/coarse-grained hybrid predictions of distribution coefficients in SAMPL5Samuel Genheden, Jonathan W Essex
Journal of Medicinal Chemistry|October 7, 2008
Hit identification and binding mode predictions by rigorous free energy simulationsJulien Michel, Jonathan W Essex
Journal of Computer-Aided Molecular Design|May 29, 2010
Prediction of protein-ligand binding affinity by free energy simulations: assumptions, pitfalls and expectationsJulien Michel, Jonathan W Essex
Journal of Chemical Theory and Computation|November 18, 2015
A simple and transferable all-atom/coarse-grained hybrid model to study membrane processesSamuel Genheden, Jonathan W Essex
Journal of Chemical Theory and Computation|November 27, 2015
Study of the Conformational Dynamics of the Catalytic Loop of WT and G140A/G149A HIV-1 Integrase Core Domain Using Reversible Digitally Filtered Molecular DynamicsSarah L Williams, Jonathan W Essex
Journal of Chemical Theory and Computation|June 25, 2016
Evaluating Parametrization Protocols for Hydration Free Energy Calculations with the AMOEBA Polarizable Force FieldRichard T Bradshaw, Jonathan W Essex
Molecular Informatics|July 28, 2016
Rigorous Free Energy Calculations in Structure-Based Drug DesignJulien Michel, Nicolas Foloppe, Jonathan W Essex
Journal of Physics. Condensed Matter : an Institute of Physics Journal|March 11, 2011
Coarse-grain modelling of DMPC and DOPC lipid bilayersMario Orsi, Julien Michel, Jonathan W Essex
Pageof 11

Showing results (1-10 of 105) with videos related to

Sort By:
Pageof 11
Plos One|December 24, 2011
The ELBA force field for coarse-grain modeling of lipid membranesMario Orsi, Jonathan W Essex
Faraday Discussions|June 29, 2013
Physical properties of mixed bilayers containing lamellar and nonlamellar lipids: insights from coarse-grain molecular dynamics simulationsMario Orsi, Jonathan W Essex
Journal of Computer-Aided Molecular Design|July 28, 2016
All-atom/coarse-grained hybrid predictions of distribution coefficients in SAMPL5Samuel Genheden, Jonathan W Essex
Journal of Medicinal Chemistry|October 7, 2008
Hit identification and binding mode predictions by rigorous free energy simulationsJulien Michel, Jonathan W Essex
Journal of Computer-Aided Molecular Design|May 29, 2010
Prediction of protein-ligand binding affinity by free energy simulations: assumptions, pitfalls and expectationsJulien Michel, Jonathan W Essex
Journal of Chemical Theory and Computation|November 18, 2015
A simple and transferable all-atom/coarse-grained hybrid model to study membrane processesSamuel Genheden, Jonathan W Essex
Journal of Chemical Theory and Computation|November 27, 2015
Study of the Conformational Dynamics of the Catalytic Loop of WT and G140A/G149A HIV-1 Integrase Core Domain Using Reversible Digitally Filtered Molecular DynamicsSarah L Williams, Jonathan W Essex
Journal of Chemical Theory and Computation|June 25, 2016
Evaluating Parametrization Protocols for Hydration Free Energy Calculations with the AMOEBA Polarizable Force FieldRichard T Bradshaw, Jonathan W Essex
Molecular Informatics|July 28, 2016
Rigorous Free Energy Calculations in Structure-Based Drug DesignJulien Michel, Nicolas Foloppe, Jonathan W Essex
Journal of Physics. Condensed Matter : an Institute of Physics Journal|March 11, 2011
Coarse-grain modelling of DMPC and DOPC lipid bilayersMario Orsi, Julien Michel, Jonathan W Essex
Pageof 11