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Manuel Sparta

Showing results (11-20 of 17) with videos related to

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Journal of Chemical Theory and Computation|June 9, 2018
Toward Accurate QM/MM Reaction Barriers with Large QM Regions Using Domain Based Pair Natural Orbital Coupled Cluster TheoryGiovanni Bistoni, Iakov Polyak, Manuel Sparta, et al.
Journal of Chemical Theory and Computation|November 29, 2015
New Formulation and Implementation of Vibrational Self-Consistent Field TheoryMikkel B Hansen, Manuel Sparta, Peter Seidler, et al.
Journal of Chemical Theory and Computation|December 1, 2015
Using Electronic Energy Derivative Information in Automated Potential Energy Surface Construction for Vibrational CalculationsManuel Sparta, Mikkel B Hansen, Eduard Matito, et al.
Journal of Chemical Theory and Computation|June 8, 2017
Multilevel Approaches within the Local Pair Natural Orbital FrameworkManuel Sparta, Marius Retegan, Peter Pinski, et al.
Biophysical Journal|September 6, 2012
Hybrid dynamics simulation engine for metalloproteinsManuel Sparta, David Shirvanyants, Feng Ding, et al.
Journal of Chemical Theory and Computation|February 19, 2016
Exploring the Accuracy Limits of Local Pair Natural Orbital Coupled-Cluster TheoryDimitrios G Liakos, Manuel Sparta, Manoj K Kesharwani, et al.
Journal of Chemical Theory and Computation|August 27, 2016
Decomposition of Intermolecular Interaction Energies within the Local Pair Natural Orbital Coupled Cluster FrameworkWolfgang B Schneider, Giovanni Bistoni, Manuel Sparta, et al.
Pageof 2

Showing results (11-20 of 17) with videos related to

Sort By:
Pageof 2
You have reached the last page of results.This site can display upto 17 results.
Journal of Chemical Theory and Computation|June 9, 2018
Toward Accurate QM/MM Reaction Barriers with Large QM Regions Using Domain Based Pair Natural Orbital Coupled Cluster TheoryGiovanni Bistoni, Iakov Polyak, Manuel Sparta, et al.
Journal of Chemical Theory and Computation|November 29, 2015
New Formulation and Implementation of Vibrational Self-Consistent Field TheoryMikkel B Hansen, Manuel Sparta, Peter Seidler, et al.
Journal of Chemical Theory and Computation|December 1, 2015
Using Electronic Energy Derivative Information in Automated Potential Energy Surface Construction for Vibrational CalculationsManuel Sparta, Mikkel B Hansen, Eduard Matito, et al.
Journal of Chemical Theory and Computation|June 8, 2017
Multilevel Approaches within the Local Pair Natural Orbital FrameworkManuel Sparta, Marius Retegan, Peter Pinski, et al.
Biophysical Journal|September 6, 2012
Hybrid dynamics simulation engine for metalloproteinsManuel Sparta, David Shirvanyants, Feng Ding, et al.
Journal of Chemical Theory and Computation|February 19, 2016
Exploring the Accuracy Limits of Local Pair Natural Orbital Coupled-Cluster TheoryDimitrios G Liakos, Manuel Sparta, Manoj K Kesharwani, et al.
Journal of Chemical Theory and Computation|August 27, 2016
Decomposition of Intermolecular Interaction Energies within the Local Pair Natural Orbital Coupled Cluster FrameworkWolfgang B Schneider, Giovanni Bistoni, Manuel Sparta, et al.
Pageof 2