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Maxim Tafipolsky

Showing results (1-10 of 17) with videos related to

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The Journal of Physical Chemistry. A|June 15, 2016
Challenging Dogmas: Hydrogen Bond RevisitedMaxim Tafipolsky
Journal of Chemical Theory and Computation|December 4, 2015
A Consistent Force Field for the Carboxylate GroupMaxim Tafipolsky, Rochus Schmid
Journal of Chemical Theory and Computation|November 25, 2015
Accurate Intermolecular Potentials with Physically Grounded ElectrostaticsMaxim Tafipolsky, Bernd Engels
The Journal of Chemical Physics|May 13, 2006
A general and efficient pseudopotential Fourier filtering scheme for real space methods using mask functionsMaxim Tafipolsky, Rochus Schmid
Journal of the American Chemical Society|August 30, 2008
An accurate force field model for the strain energy analysis of the covalent organic framework COF-102Rochus Schmid, Maxim Tafipolsky
Journal of Chemical Theory and Computation|January 29, 2016
Toward a Physically Motivated Force Field: Hydrogen Bond Directionality from a Symmetry-Adapted Perturbation Theory PerspectiveMaxim Tafipolsky, Kay Ansorg
The Journal of Physical Chemistry. B|January 13, 2009
Systematic first principles parameterization of force fields for metal-organic frameworks using a genetic algorithm approachMaxim Tafipolsky, Rochus Schmid
Journal of Computational Chemistry|February 16, 2007
Ab initio parametrized MM3 force field for the metal-organic framework MOF-5Maxim Tafipolsky, Saeed Amirjalayer, Rochus Schmid
Angewandte Chemie (International Ed. in English)|November 30, 2006
Molecular dynamics simulation of benzene diffusion in MOF-5: importance of lattice dynamicsSaeed Amirjalayer, Maxim Tafipolsky, Rochus Schmid
The Journal of Physical Chemistry. B|August 9, 2013
Cation-π interactions: accurate intermolecular potential from symmetry-adapted perturbation theoryKay Ansorg, Maxim Tafipolsky, Bernd Engels
Pageof 2

Showing results (1-10 of 17) with videos related to

Sort By:
Pageof 2
The Journal of Physical Chemistry. A|June 15, 2016
Challenging Dogmas: Hydrogen Bond RevisitedMaxim Tafipolsky
Journal of Chemical Theory and Computation|December 4, 2015
A Consistent Force Field for the Carboxylate GroupMaxim Tafipolsky, Rochus Schmid
Journal of Chemical Theory and Computation|November 25, 2015
Accurate Intermolecular Potentials with Physically Grounded ElectrostaticsMaxim Tafipolsky, Bernd Engels
The Journal of Chemical Physics|May 13, 2006
A general and efficient pseudopotential Fourier filtering scheme for real space methods using mask functionsMaxim Tafipolsky, Rochus Schmid
Journal of the American Chemical Society|August 30, 2008
An accurate force field model for the strain energy analysis of the covalent organic framework COF-102Rochus Schmid, Maxim Tafipolsky
Journal of Chemical Theory and Computation|January 29, 2016
Toward a Physically Motivated Force Field: Hydrogen Bond Directionality from a Symmetry-Adapted Perturbation Theory PerspectiveMaxim Tafipolsky, Kay Ansorg
The Journal of Physical Chemistry. B|January 13, 2009
Systematic first principles parameterization of force fields for metal-organic frameworks using a genetic algorithm approachMaxim Tafipolsky, Rochus Schmid
Journal of Computational Chemistry|February 16, 2007
Ab initio parametrized MM3 force field for the metal-organic framework MOF-5Maxim Tafipolsky, Saeed Amirjalayer, Rochus Schmid
Angewandte Chemie (International Ed. in English)|November 30, 2006
Molecular dynamics simulation of benzene diffusion in MOF-5: importance of lattice dynamicsSaeed Amirjalayer, Maxim Tafipolsky, Rochus Schmid
The Journal of Physical Chemistry. B|August 9, 2013
Cation-π interactions: accurate intermolecular potential from symmetry-adapted perturbation theoryKay Ansorg, Maxim Tafipolsky, Bernd Engels
Pageof 2