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Jason Swails

Showing results (1-10 of 8) with videos related to

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Journal of Biomolecular NMR|August 3, 2015
AFNMR: automated fragmentation quantum mechanical calculation of NMR chemical shifts for biomoleculesJason Swails, Tong Zhu, Xiao He, et al.
Journal of the American Chemical Society|January 9, 2018
A Coupled Ionization-Conformational Equilibrium Is Required To Understand the Properties of Ionizable Residues in the Hydrophobic Interior of Staphylococcal NucleaseJinfeng Liu, Jason Swails, John Z H Zhang, et al.
Plos Computational Biology|July 27, 2017
OpenMM 7: Rapid development of high performance algorithms for molecular dynamicsPeter Eastman, Jason Swails, John D Chodera, et al.
The Journal of Physical Chemistry. B|August 12, 2016
Advanced Potential Energy Surfaces for Molecular SimulationAlex Albaugh, Henry A Boateng, Richard T Bradshaw, et al.
The Journal of Physical Chemistry. B|December 28, 2023
OpenMM 8: Molecular Dynamics Simulation with Machine Learning PotentialsPeter Eastman, Raimondas Galvelis, Raúl P Peláez, et al.
Arxiv|November 21, 2023
OpenMM 8: Molecular Dynamics Simulation with Machine Learning PotentialsPeter Eastman, Raimondas Galvelis, Raúl P Peláez, et al.
Journal of Chemical Information and Modeling|July 29, 2025
Recent Developments in Amber Biomolecular SimulationsDavid A Case, David S Cerutti, Vinícius Wilian D Cruzeiro, et al.
Journal of Chemical Information and Modeling|October 8, 2023
AmberToolsDavid A Case, Hasan Metin Aktulga, Kellon Belfon, et al.
Pageof 1

Showing results (1-10 of 8) with videos related to

Sort By:
Pageof 1
Journal of Biomolecular NMR|August 3, 2015
AFNMR: automated fragmentation quantum mechanical calculation of NMR chemical shifts for biomoleculesJason Swails, Tong Zhu, Xiao He, et al.
Journal of the American Chemical Society|January 9, 2018
A Coupled Ionization-Conformational Equilibrium Is Required To Understand the Properties of Ionizable Residues in the Hydrophobic Interior of Staphylococcal NucleaseJinfeng Liu, Jason Swails, John Z H Zhang, et al.
Plos Computational Biology|July 27, 2017
OpenMM 7: Rapid development of high performance algorithms for molecular dynamicsPeter Eastman, Jason Swails, John D Chodera, et al.
The Journal of Physical Chemistry. B|August 12, 2016
Advanced Potential Energy Surfaces for Molecular SimulationAlex Albaugh, Henry A Boateng, Richard T Bradshaw, et al.
The Journal of Physical Chemistry. B|December 28, 2023
OpenMM 8: Molecular Dynamics Simulation with Machine Learning PotentialsPeter Eastman, Raimondas Galvelis, Raúl P Peláez, et al.
Arxiv|November 21, 2023
OpenMM 8: Molecular Dynamics Simulation with Machine Learning PotentialsPeter Eastman, Raimondas Galvelis, Raúl P Peláez, et al.
Journal of Chemical Information and Modeling|July 29, 2025
Recent Developments in Amber Biomolecular SimulationsDavid A Case, David S Cerutti, Vinícius Wilian D Cruzeiro, et al.
Journal of Chemical Information and Modeling|October 8, 2023
AmberToolsDavid A Case, Hasan Metin Aktulga, Kellon Belfon, et al.
Pageof 1