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Andriy Kovalenko

Showing results (1-10 of 91) with videos related to

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Molecules (Basel, Switzerland)|October 14, 2022
Understanding the Liquid States of Cyclic Hydrocarbons Containing N, O, and S Atoms via the 3D-RISM-KH Molecular Solvation TheoryDipankar Roy, Andriy Kovalenko
Journal of Chemical Theory and Computation|November 27, 2015
Spatial Decomposition Analysis of the Thermodynamics of Cyclodextrin ComplexationTakeshi Yamazaki, Andriy Kovalenko
International Journal of Molecular Sciences|June 2, 2021
Biomolecular Simulations with the Three-Dimensional Reference Interaction Site Model with the Kovalenko-Hirata Closure Molecular Solvation TheoryDipankar Roy, Andriy Kovalenko
Journal of Molecular Modeling|January 12, 2022
Response to Comment on "Density Functional Theory and 3D-RISM-KH molecular theory of solvation studies of CO<sub>2</sub> reduction on Cu-, Cu<sub>2</sub>O-, Fe-, and F<sub>e</sub>3O<sub>4</sub>-based nanocatalysts"Andriy Kovalenko, Vladimir Neburchilov
The Journal of Chemical Physics|August 31, 2004
Molecular description of the collapse of hydrophobic polymer chains in waterLucian Livadaru, Andriy Kovalenko
Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics|April 3, 2012
Interpretation of atomic motion in flexible molecules: accelerating molecular dynamics simulationsIgor Omelyan, Andriy Kovalenko
Nano Letters|January 13, 2006
Fundamental mechanism of translocation across liquidlike membranes: toward control over nanoparticle behaviorLucian Livadaru, Andriy Kovalenko
Physical Chemistry Chemical Physics : PCCP|October 3, 2017
Multiscale methods framework: self-consistent coupling of molecular theory of solvation with quantum chemistry, molecular simulations, and dissipative particle dynamicsAndriy Kovalenko, Sergey Gusarov
The Journal of Chemical Physics|January 7, 2014
Multiple time step molecular dynamics in the optimized isokinetic ensemble steered with the molecular theory of solvation: accelerating with advanced extrapolation of effective solvation forcesIgor Omelyan, Andriy Kovalenko
Journal of Colloid and Interface Science|September 19, 2006
The role of capillary and surface forces in the crossover behavior of solid nanoparticles at liquid interfacesLucian Livadaru, Andriy Kovalenko
Pageof 10

Showing results (1-10 of 91) with videos related to

Sort By:
Pageof 10
Molecules (Basel, Switzerland)|October 14, 2022
Understanding the Liquid States of Cyclic Hydrocarbons Containing N, O, and S Atoms via the 3D-RISM-KH Molecular Solvation TheoryDipankar Roy, Andriy Kovalenko
Journal of Chemical Theory and Computation|November 27, 2015
Spatial Decomposition Analysis of the Thermodynamics of Cyclodextrin ComplexationTakeshi Yamazaki, Andriy Kovalenko
International Journal of Molecular Sciences|June 2, 2021
Biomolecular Simulations with the Three-Dimensional Reference Interaction Site Model with the Kovalenko-Hirata Closure Molecular Solvation TheoryDipankar Roy, Andriy Kovalenko
Journal of Molecular Modeling|January 12, 2022
Response to Comment on "Density Functional Theory and 3D-RISM-KH molecular theory of solvation studies of CO<sub>2</sub> reduction on Cu-, Cu<sub>2</sub>O-, Fe-, and F<sub>e</sub>3O<sub>4</sub>-based nanocatalysts"Andriy Kovalenko, Vladimir Neburchilov
The Journal of Chemical Physics|August 31, 2004
Molecular description of the collapse of hydrophobic polymer chains in waterLucian Livadaru, Andriy Kovalenko
Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics|April 3, 2012
Interpretation of atomic motion in flexible molecules: accelerating molecular dynamics simulationsIgor Omelyan, Andriy Kovalenko
Nano Letters|January 13, 2006
Fundamental mechanism of translocation across liquidlike membranes: toward control over nanoparticle behaviorLucian Livadaru, Andriy Kovalenko
Physical Chemistry Chemical Physics : PCCP|October 3, 2017
Multiscale methods framework: self-consistent coupling of molecular theory of solvation with quantum chemistry, molecular simulations, and dissipative particle dynamicsAndriy Kovalenko, Sergey Gusarov
The Journal of Chemical Physics|January 7, 2014
Multiple time step molecular dynamics in the optimized isokinetic ensemble steered with the molecular theory of solvation: accelerating with advanced extrapolation of effective solvation forcesIgor Omelyan, Andriy Kovalenko
Journal of Colloid and Interface Science|September 19, 2006
The role of capillary and surface forces in the crossover behavior of solid nanoparticles at liquid interfacesLucian Livadaru, Andriy Kovalenko
Pageof 10