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Carlos Nieto-Draghi

Showing results (1-10 of 29) with videos related to

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The Journal of Physical Chemistry. B|February 21, 2019
Thermodynamically Consistent Force Field for Coarse-Grained Modeling of Aqueous Electrolyte SolutionCarlos Nieto-Draghi, Bernard Rousseau
The Journal of Physical Chemistry. B|March 29, 2007
Anisotropic united atom model including the electrostatic interactions of benzenePatrick Bonnaud, Carlos Nieto-Draghi, Philippe Ungerer
The Journal of Chemical Physics|September 1, 2006
Optimization of the anisotropic united atoms intermolecular potential for n-alkanes: improvement of transport propertiesCarlos Nieto-Draghi, Philippe Ungerer, Bernard Rousseau
Molecular Informatics|November 5, 2019
Inverse-QSPR for de novo Design: A ReviewPhilippe Gantzer, Benoit Creton, Carlos Nieto-Draghi
Journal of Chemical Information and Modeling|August 18, 2021
Comparisons of Molecular Structure Generation Methods Based on Fragment Assemblies and Genetic GraphsPhilippe Gantzer, Benoit Creton, Carlos Nieto-Draghi
The Journal of Chemical Physics|April 20, 2005
Computing the Soret coefficient in aqueous mixtures using boundary driven nonequilibrium molecular dynamicsCarlos Nieto-Draghi, Josep Bonet Avalos, Bernard Rousseau
The Journal of Chemical Physics|July 23, 2005
Transport coefficients and dynamic properties of hydrogen sulfide from molecular simulationCarlos Nieto-Draghi, Allan D Mackie, Josep Bonet Avalos
Physical Review Letters|August 11, 2005
Histogram reweighting method for dynamic propertiesCarlos Nieto-Draghi, Javier Pérez-Pellitero, Josep Bonet Avalos
The Journal of Physical Chemistry. B|April 28, 2010
Extension of a charged anisotropic united atoms model to polycyclic aromatic compoundsBenoit Creton, Theodorus de Bruin, Véronique Lachet, et al.
The Journal of Physical Chemistry. B|April 16, 2009
Prediction of transport properties by molecular simulation: methanol and ethanol and their mixtureGabriela Guevara-Carrion, Carlos Nieto-Draghi, Jadran Vrabec, et al.
Pageof 3

Showing results (1-10 of 29) with videos related to

Sort By:
Pageof 3
The Journal of Physical Chemistry. B|February 21, 2019
Thermodynamically Consistent Force Field for Coarse-Grained Modeling of Aqueous Electrolyte SolutionCarlos Nieto-Draghi, Bernard Rousseau
The Journal of Physical Chemistry. B|March 29, 2007
Anisotropic united atom model including the electrostatic interactions of benzenePatrick Bonnaud, Carlos Nieto-Draghi, Philippe Ungerer
The Journal of Chemical Physics|September 1, 2006
Optimization of the anisotropic united atoms intermolecular potential for n-alkanes: improvement of transport propertiesCarlos Nieto-Draghi, Philippe Ungerer, Bernard Rousseau
Molecular Informatics|November 5, 2019
Inverse-QSPR for de novo Design: A ReviewPhilippe Gantzer, Benoit Creton, Carlos Nieto-Draghi
Journal of Chemical Information and Modeling|August 18, 2021
Comparisons of Molecular Structure Generation Methods Based on Fragment Assemblies and Genetic GraphsPhilippe Gantzer, Benoit Creton, Carlos Nieto-Draghi
The Journal of Chemical Physics|April 20, 2005
Computing the Soret coefficient in aqueous mixtures using boundary driven nonequilibrium molecular dynamicsCarlos Nieto-Draghi, Josep Bonet Avalos, Bernard Rousseau
The Journal of Chemical Physics|July 23, 2005
Transport coefficients and dynamic properties of hydrogen sulfide from molecular simulationCarlos Nieto-Draghi, Allan D Mackie, Josep Bonet Avalos
Physical Review Letters|August 11, 2005
Histogram reweighting method for dynamic propertiesCarlos Nieto-Draghi, Javier Pérez-Pellitero, Josep Bonet Avalos
The Journal of Physical Chemistry. B|April 28, 2010
Extension of a charged anisotropic united atoms model to polycyclic aromatic compoundsBenoit Creton, Theodorus de Bruin, Véronique Lachet, et al.
The Journal of Physical Chemistry. B|April 16, 2009
Prediction of transport properties by molecular simulation: methanol and ethanol and their mixtureGabriela Guevara-Carrion, Carlos Nieto-Draghi, Jadran Vrabec, et al.
Pageof 3