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Head-Gordon

Showing results (81-90 of 649) with videos related to

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Physical Chemistry Chemical Physics : PCCP|October 24, 2009
Restricted active space spin-flip configuration interaction approach: theory, implementation and examplesDavid Casanova, Martin Head-Gordon
Journal of Chemical Theory and Computation|April 22, 2017
Performance of the AMOEBA Water Model in the Vicinity of QM Solutes: A Diagnosis Using Energy Decomposition AnalysisYuezhi Mao, Yihan Shao, Jacek Dziedzic, et al.
Proteins|January 29, 2000
Redesigning the hydrophobic core of a model beta-sheet protein: destabilizing traps through a threading approachJ M Sorenson, T Head-Gordon
Journal of the American Chemical Society|November 22, 2001
Origin of substituent effects in the absorption spectra of peroxy radicals: time dependent density functional theory calculationsJ L Weisman, M Head-Gordon
The Journal of Chemical Physics|March 25, 2014
Non-orthogonal configuration interaction for the calculation of multielectron excited statesEric J Sundstrom, Martin Head-Gordon
The Journal of Physical Chemistry Letters|April 18, 2017
Quantifying the Role of Orbital Contraction in Chemical BondingDaniel S Levine, Martin Head-Gordon
Annual Review of Chemical and Biomolecular Engineering|March 22, 2012
Quantum mechanical modeling of catalytic processesAlexis T Bell, Martin Head-Gordon
ACS Nano|February 2, 2022
Evaporation of Water Nanodroplets on Heated Surfaces: Does Nano Matter?Luis Ruiz Pestana, Teresa Head-Gordon
Journal of Chemical Theory and Computation|August 17, 2010
A New and Efficient Poisson-Boltzmann Solver for Interaction of Multiple ProteinsEng-Hui Yap, Teresa Head-Gordon
The Journal of Physical Chemistry. A|September 3, 2010
Modeling the charge transfer between alkali metals and polycyclic aromatic hydrocarbons using electronic structure methodsThomas A Baker, Martin Head-Gordon
Pageof 65

Showing results (81-90 of 649) with videos related to

Sort By:
Pageof 65
Physical Chemistry Chemical Physics : PCCP|October 24, 2009
Restricted active space spin-flip configuration interaction approach: theory, implementation and examplesDavid Casanova, Martin Head-Gordon
Journal of Chemical Theory and Computation|April 22, 2017
Performance of the AMOEBA Water Model in the Vicinity of QM Solutes: A Diagnosis Using Energy Decomposition AnalysisYuezhi Mao, Yihan Shao, Jacek Dziedzic, et al.
Proteins|January 29, 2000
Redesigning the hydrophobic core of a model beta-sheet protein: destabilizing traps through a threading approachJ M Sorenson, T Head-Gordon
Journal of the American Chemical Society|November 22, 2001
Origin of substituent effects in the absorption spectra of peroxy radicals: time dependent density functional theory calculationsJ L Weisman, M Head-Gordon
The Journal of Chemical Physics|March 25, 2014
Non-orthogonal configuration interaction for the calculation of multielectron excited statesEric J Sundstrom, Martin Head-Gordon
The Journal of Physical Chemistry Letters|April 18, 2017
Quantifying the Role of Orbital Contraction in Chemical BondingDaniel S Levine, Martin Head-Gordon
Annual Review of Chemical and Biomolecular Engineering|March 22, 2012
Quantum mechanical modeling of catalytic processesAlexis T Bell, Martin Head-Gordon
ACS Nano|February 2, 2022
Evaporation of Water Nanodroplets on Heated Surfaces: Does Nano Matter?Luis Ruiz Pestana, Teresa Head-Gordon
Journal of Chemical Theory and Computation|August 17, 2010
A New and Efficient Poisson-Boltzmann Solver for Interaction of Multiple ProteinsEng-Hui Yap, Teresa Head-Gordon
The Journal of Physical Chemistry. A|September 3, 2010
Modeling the charge transfer between alkali metals and polycyclic aromatic hydrocarbons using electronic structure methodsThomas A Baker, Martin Head-Gordon
Pageof 65