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Bert L de Groot

Showing results (51-60 of 202) with videos related to

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Frontiers in Physiology|March 18, 2017
Localization and Ordering of Lipids Around Aquaporin-0: Protein and Lipid Mobility EffectsRodolfo Briones, Camilo Aponte-Santamaría, Bert L de Groot
Journal of Chemical Theory and Computation|April 2, 2025
Improving p<i>K</i><sub>a</sub> Predictions with Reparameterized Force Fields and Free Energy CalculationsCarter J Wilson, Vytautas Gapsys, Bert L de Groot
Journal of Computational Chemistry|March 12, 2024
Resolving coupled pH titrations using alchemical free energy calculationsCarter J Wilson, Bert L de Groot, Vytautas Gapsys
Plos Computational Biology|May 14, 2010
Spontaneous quaternary and tertiary T-R transitions of human hemoglobin in molecular dynamics simulationJochen S Hub, Marcus B Kubitzki, Bert L de Groot
Journal of Molecular Biology|October 8, 2003
The mechanism of proton exclusion in the aquaporin-1 water channelBert L de Groot, Tomaso Frigato, Volkhard Helms, et al.
Current Opinion in Structural Biology|July 19, 2024
Biomolecular simulations at the exascale: From drug design to organelles and beyondVytautas Gapsys, Wojciech Kopec, Dirk Matthes, et al.
Journal of Chemical Theory and Computation|December 2, 2018
Interpretation of Interfacial Protein Spectra with Enhanced Molecular Simulation EnsemblesHelmut Lutz, Vance Jaeger, Tobias Weidner, et al.
Angewandte Chemie (International Ed. in English)|April 29, 2016
Accurate and Rigorous Prediction of the Changes in Protein Free Energies in a Large-Scale Mutation ScanVytautas Gapsys, Servaas Michielssens, Daniel Seeliger, et al.
ACS Chemical Neuroscience|September 15, 2017
Resolving the Atomistic Modes of Anle138b Inhibitory Action on Peptide Oligomer FormationDirk Matthes, Vytautas Gapsys, Christian Griesinger, et al.
Plos One|May 12, 2011
Mapping the conformational dynamics and pathways of spontaneous steric zipper Peptide oligomerizationDirk Matthes, Vytautas Gapsys, Venita Daebel, et al.
Pageof 21

Showing results (51-60 of 202) with videos related to

Sort By:
Pageof 21
Frontiers in Physiology|March 18, 2017
Localization and Ordering of Lipids Around Aquaporin-0: Protein and Lipid Mobility EffectsRodolfo Briones, Camilo Aponte-Santamaría, Bert L de Groot
Journal of Chemical Theory and Computation|April 2, 2025
Improving p<i>K</i><sub>a</sub> Predictions with Reparameterized Force Fields and Free Energy CalculationsCarter J Wilson, Vytautas Gapsys, Bert L de Groot
Journal of Computational Chemistry|March 12, 2024
Resolving coupled pH titrations using alchemical free energy calculationsCarter J Wilson, Bert L de Groot, Vytautas Gapsys
Plos Computational Biology|May 14, 2010
Spontaneous quaternary and tertiary T-R transitions of human hemoglobin in molecular dynamics simulationJochen S Hub, Marcus B Kubitzki, Bert L de Groot
Journal of Molecular Biology|October 8, 2003
The mechanism of proton exclusion in the aquaporin-1 water channelBert L de Groot, Tomaso Frigato, Volkhard Helms, et al.
Current Opinion in Structural Biology|July 19, 2024
Biomolecular simulations at the exascale: From drug design to organelles and beyondVytautas Gapsys, Wojciech Kopec, Dirk Matthes, et al.
Journal of Chemical Theory and Computation|December 2, 2018
Interpretation of Interfacial Protein Spectra with Enhanced Molecular Simulation EnsemblesHelmut Lutz, Vance Jaeger, Tobias Weidner, et al.
Angewandte Chemie (International Ed. in English)|April 29, 2016
Accurate and Rigorous Prediction of the Changes in Protein Free Energies in a Large-Scale Mutation ScanVytautas Gapsys, Servaas Michielssens, Daniel Seeliger, et al.
ACS Chemical Neuroscience|September 15, 2017
Resolving the Atomistic Modes of Anle138b Inhibitory Action on Peptide Oligomer FormationDirk Matthes, Vytautas Gapsys, Christian Griesinger, et al.
Plos One|May 12, 2011
Mapping the conformational dynamics and pathways of spontaneous steric zipper Peptide oligomerizationDirk Matthes, Vytautas Gapsys, Venita Daebel, et al.
Pageof 21