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Journal of Chemical Theory and Computation|April 6, 2017
Probing a Continuous Polar Defect: A Reaction Coordinate for Pore Formation in Lipid MembranesJochen S Hub, Neha AwasthiProceedings of the National Academy of Sciences of the United States of America|April 23, 2021
The loops of the N-SH2 binding cleft do not serve as allosteric switch in SHP2 activationMassimiliano Anselmi, Jochen S HubScientific Reports|September 22, 2017
Energetics and mechanism of anion permeation across formate-nitrite transportersKalina Atkovska, Jochen S HubPhysical Review Letters|April 19, 2024
Molecular Simulations Reveal the Free Energy Landscape and Transition State of Membrane ElectroporationGari Kasparyan, Jochen S HubPhysical Review Letters|October 13, 2023
Molecular Simulations of Liquid Jet Explosions and Shock Waves Induced by X-Ray Free-Electron LasersLeonie Chatzimagas, Jochen S HubMethods in Enzymology|November 21, 2022
Predicting solution scattering patterns with explicit-solvent molecular simulationsLeonie Chatzimagas, Jochen S HubMethods in Enzymology|January 14, 2023
Structure and ensemble refinement against SAXS data: Combining MD simulations with Bayesian inference or with the maximum entropy principleLeonie Chatzimagas, Jochen S HubJournal of Chemical Theory and Computation|April 13, 2023
Equivalence of Charge Imbalance and External Electric Fields during Free Energy Calculations of Membrane ElectroporationGari Kasparyan, Jochen S HubMethods in Molecular Biology (Clifton, N.J.)|September 5, 2023
Revealing Allostery in PTPN11 SH2 Domains from MD SimulationsMassimiliano Anselmi, Jochen S HubThe Journal of Physical Chemistry Letters|December 5, 2015
Structural Properties of Protein-Detergent Complexes from SAXS and MD SimulationsPo-Chia Chen, Jochen S HubPageof 11