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Journal of Molecular Graphics & Modelling
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May 22, 2015
Phase-transition properties of glycerol-dipalmitate lipid bilayers investigated using molecular dynamics simulation
Monika Laner, Philippe H Hünenberger
Journal of Computational Chemistry
|
June 2, 2006
A multiple time step algorithm compatible with a large number of distance classes and an arbitrary distance dependence of the time step size for the fast evaluation of nonbonded interactions in molecular simulations
Vincent Kräutler, Philippe H Hünenberger
Protein Engineering
|
November 25, 2003
Effect of mutations involving charged residues on the stability of staphylococcal nuclease: a continuum electrostatics study
Ulf Börjesson, Philippe H Hünenberger
Journal of Molecular Graphics & Modelling
|
December 2, 2014
Effect of methanol on the phase-transition properties of glycerol-monopalmitate lipid bilayers investigated using molecular dynamics simulations: in quest of the biphasic effect
Monika Laner, Philippe H Hünenberger
The Journal of Physical Chemistry. B
|
August 4, 2006
Interaction of the sugars trehalose, maltose and glucose with a phospholipid bilayer: a comparative molecular dynamics study
Cristina S Pereira, Philippe H Hünenberger
The Journal of Physical Chemistry. B
|
May 14, 2016
Origin of Asymmetric Solvation Effects for Ions in Water and Organic Solvents Investigated Using Molecular Dynamics Simulations: The Swain Acity-Basity Scale Revisited
Maria M Reif, Philippe H Hünenberger
Journal of Chemical Theory and Computation
|
March 2, 2019
Alchemical Free-Energy Calculations by Multiple-Replica λ-Dynamics: The Conveyor Belt Thermodynamic Integration Scheme
David F Hahn, Philippe H Hünenberger
The Journal of Chemical Physics
|
June 21, 2006
Computation of methodology-independent ionic solvation free energies from molecular simulations. II. The hydration free energy of the sodium cation
Mika A Kastenholz, Philippe H Hünenberger
Journal of Computational Chemistry
|
March 10, 2011
A reoptimized GROMOS force field for hexopyranose-based carbohydrates accounting for the relative free energies of ring conformers, anomers, epimers, hydroxymethyl rotamers, and glycosidic linkage conformers
Halvor S Hansen, Philippe H Hünenberger
The Journal of Chemical Physics
|
April 19, 2011
Computation of methodology-independent single-ion solvation properties from molecular simulations. III. Correction terms for the solvation free energies, enthalpies, entropies, heat capacities, volumes, compressibilities, and expansivities of solvated ions
Maria M Reif, Philippe H Hünenberger
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of 11
Search research articles
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Showing results (1-10 of 103) with videos related to
Sort By:
Page
of 11
Journal of Molecular Graphics & Modelling
|
May 22, 2015
Phase-transition properties of glycerol-dipalmitate lipid bilayers investigated using molecular dynamics simulation
Monika Laner, Philippe H Hünenberger
Journal of Computational Chemistry
|
June 2, 2006
A multiple time step algorithm compatible with a large number of distance classes and an arbitrary distance dependence of the time step size for the fast evaluation of nonbonded interactions in molecular simulations
Vincent Kräutler, Philippe H Hünenberger
Protein Engineering
|
November 25, 2003
Effect of mutations involving charged residues on the stability of staphylococcal nuclease: a continuum electrostatics study
Ulf Börjesson, Philippe H Hünenberger
Journal of Molecular Graphics & Modelling
|
December 2, 2014
Effect of methanol on the phase-transition properties of glycerol-monopalmitate lipid bilayers investigated using molecular dynamics simulations: in quest of the biphasic effect
Monika Laner, Philippe H Hünenberger
The Journal of Physical Chemistry. B
|
August 4, 2006
Interaction of the sugars trehalose, maltose and glucose with a phospholipid bilayer: a comparative molecular dynamics study
Cristina S Pereira, Philippe H Hünenberger
The Journal of Physical Chemistry. B
|
May 14, 2016
Origin of Asymmetric Solvation Effects for Ions in Water and Organic Solvents Investigated Using Molecular Dynamics Simulations: The Swain Acity-Basity Scale Revisited
Maria M Reif, Philippe H Hünenberger
Journal of Chemical Theory and Computation
|
March 2, 2019
Alchemical Free-Energy Calculations by Multiple-Replica λ-Dynamics: The Conveyor Belt Thermodynamic Integration Scheme
David F Hahn, Philippe H Hünenberger
The Journal of Chemical Physics
|
June 21, 2006
Computation of methodology-independent ionic solvation free energies from molecular simulations. II. The hydration free energy of the sodium cation
Mika A Kastenholz, Philippe H Hünenberger
Journal of Computational Chemistry
|
March 10, 2011
A reoptimized GROMOS force field for hexopyranose-based carbohydrates accounting for the relative free energies of ring conformers, anomers, epimers, hydroxymethyl rotamers, and glycosidic linkage conformers
Halvor S Hansen, Philippe H Hünenberger
The Journal of Chemical Physics
|
April 19, 2011
Computation of methodology-independent single-ion solvation properties from molecular simulations. III. Correction terms for the solvation free energies, enthalpies, entropies, heat capacities, volumes, compressibilities, and expansivities of solvated ions
Maria M Reif, Philippe H Hünenberger
Page
of 11