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Isaiah Sumner

Showing results (1-10 of 17) with videos related to

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Journal of Chemical Theory and Computation|August 31, 2012
Analysis of Hydrogen Tunneling in an Enzyme Active Site using von Neumann MeasurementsIsaiah Sumner, Srinivasan S Iyengar
The Journal of Physical Chemistry. B|February 8, 2012
Proton transport pathways in [NiFe]-hydrogenaseIsaiah Sumner, Gregory A Voth
The Journal of Physical Chemistry. A|September 27, 2007
Quantum wavepacket ab initio molecular dynamics: an approach for computing dynamically averaged vibrational spectra including critical nuclear quantum effectsIsaiah Sumner, Srinivasan S Iyengar
The Journal of Chemical Physics|August 14, 2008
Combining quantum wavepacket ab initio molecular dynamics with QM/MM and QM/QM techniques: Implementation blending ONIOM and empirical valence bond theoryIsaiah Sumner, Srinivasan S Iyengar
Journal of Chemical Information and Modeling|June 7, 2022
On the Possibility That Bond Strain Is the Mechanism of RING E3 Activation in the E2-Catalyzed Ubiquitination ReactionJay-Anne K Johnson, Isaiah Sumner
Journal of Chemical Theory and Computation|December 3, 2015
Computational Improvements to Quantum Wave Packet ab Initio Molecular Dynamics Using a Potential-Adapted, Time-Dependent Deterministic Sampling TechniqueJacek Jakowski, Isaiah Sumner, Srinivasan S Iyengar
The Journal of Physical Chemistry. B|June 6, 2008
Hydrogen tunneling in an enzyme active site: a quantum wavepacket dynamical perspectiveSrinivasan S Iyengar, Isaiah Sumner, Jacek Jakowski
Journal of Molecular Graphics & Modelling|August 4, 2017
Molecular dynamics simulations reveal a new role for a conserved active site asparagine in a ubiquitin-conjugating enzymeR Hunter Wilson, Serban Zamfir, Isaiah Sumner
The Journal of Physical Chemistry. B|July 31, 2012
Gauging the flexibility of the active site in soybean lipoxygenase-1 (SLO-1) through an atom-centered density matrix propagation (ADMP) treatment that facilitates the sampling of rare eventsPrasad Phatak, Isaiah Sumner, Srinivasan S Iyengar
FEBS Letters|May 24, 2015
Mechanical dissociation of the M-band titin/obscurin complex is directionally dependentTracy A Caldwell, Isaiah Sumner, Nathan T Wright
Pageof 2

Showing results (1-10 of 17) with videos related to

Sort By:
Pageof 2
Journal of Chemical Theory and Computation|August 31, 2012
Analysis of Hydrogen Tunneling in an Enzyme Active Site using von Neumann MeasurementsIsaiah Sumner, Srinivasan S Iyengar
The Journal of Physical Chemistry. B|February 8, 2012
Proton transport pathways in [NiFe]-hydrogenaseIsaiah Sumner, Gregory A Voth
The Journal of Physical Chemistry. A|September 27, 2007
Quantum wavepacket ab initio molecular dynamics: an approach for computing dynamically averaged vibrational spectra including critical nuclear quantum effectsIsaiah Sumner, Srinivasan S Iyengar
The Journal of Chemical Physics|August 14, 2008
Combining quantum wavepacket ab initio molecular dynamics with QM/MM and QM/QM techniques: Implementation blending ONIOM and empirical valence bond theoryIsaiah Sumner, Srinivasan S Iyengar
Journal of Chemical Information and Modeling|June 7, 2022
On the Possibility That Bond Strain Is the Mechanism of RING E3 Activation in the E2-Catalyzed Ubiquitination ReactionJay-Anne K Johnson, Isaiah Sumner
Journal of Chemical Theory and Computation|December 3, 2015
Computational Improvements to Quantum Wave Packet ab Initio Molecular Dynamics Using a Potential-Adapted, Time-Dependent Deterministic Sampling TechniqueJacek Jakowski, Isaiah Sumner, Srinivasan S Iyengar
The Journal of Physical Chemistry. B|June 6, 2008
Hydrogen tunneling in an enzyme active site: a quantum wavepacket dynamical perspectiveSrinivasan S Iyengar, Isaiah Sumner, Jacek Jakowski
Journal of Molecular Graphics & Modelling|August 4, 2017
Molecular dynamics simulations reveal a new role for a conserved active site asparagine in a ubiquitin-conjugating enzymeR Hunter Wilson, Serban Zamfir, Isaiah Sumner
The Journal of Physical Chemistry. B|July 31, 2012
Gauging the flexibility of the active site in soybean lipoxygenase-1 (SLO-1) through an atom-centered density matrix propagation (ADMP) treatment that facilitates the sampling of rare eventsPrasad Phatak, Isaiah Sumner, Srinivasan S Iyengar
FEBS Letters|May 24, 2015
Mechanical dissociation of the M-band titin/obscurin complex is directionally dependentTracy A Caldwell, Isaiah Sumner, Nathan T Wright
Pageof 2