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Bert L de Groot

Showing results (41-50 of 202) with videos related to

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Journal of Chemical Information and Modeling|October 30, 2025
Evaluation of the ABCG2 Charge Model in Protein-Ligand Binding Free-Energy CalculationsSudarshan Behera, Vytautas Gapsys, Bert L de Groot
ACS Central Science|January 17, 2019
Accurate Estimation of Ligand Binding Affinity Changes upon Protein MutationMatteo Aldeghi, Vytautas Gapsys, Bert L de Groot
ACS Central Science|September 5, 2019
Predicting Kinase Inhibitor Resistance: Physics-Based and Data-Driven ApproachesMatteo Aldeghi, Vytautas Gapsys, Bert L de Groot
Journal of Molecular Biology|February 14, 2012
Driving forces and structural determinants of steric zipper peptide oligomer formation elucidated by atomistic simulationsDirk Matthes, Vytautas Gapsys, Bert L de Groot
Methods in Molecular Biology (Clifton, N.J.)|October 10, 2018
Accurate Calculation of Free Energy Changes upon Amino Acid MutationMatteo Aldeghi, Bert L de Groot, Vytautas Gapsys
Plos Computational Biology|May 10, 2013
Probing the energy landscape of activation gating of the bacterial potassium channel KcsATobias Linder, Bert L de Groot, Anna Stary-Weinzinger
Nature Communications|November 28, 2019
Molecular mechanism of a potassium channel gating through activation gate-selectivity filter couplingWojciech Kopec, Brad S Rothberg, Bert L de Groot
Biophysical Journal|August 20, 2024
Effect of two activators on the gating of a K<sub>2P</sub> channelEdward Mendez-Otalvaro, Wojciech Kopec, Bert L de Groot
Handbook of Experimental Pharmacology|December 20, 2008
Dynamics and energetics of permeation through aquaporins. What do we learn from molecular dynamics simulations?Jochen S Hub, Helmut Grubmüller, Bert L de Groot
Angewandte Chemie (International Ed. in English)|May 25, 2005
Molecular dynamics simulations of protein G challenge NMR-derived correlated backbone motionsOliver F Lange, Helmut Grubmüller, Bert L de Groot
Pageof 21

Showing results (41-50 of 202) with videos related to

Sort By:
Pageof 21
Journal of Chemical Information and Modeling|October 30, 2025
Evaluation of the ABCG2 Charge Model in Protein-Ligand Binding Free-Energy CalculationsSudarshan Behera, Vytautas Gapsys, Bert L de Groot
ACS Central Science|January 17, 2019
Accurate Estimation of Ligand Binding Affinity Changes upon Protein MutationMatteo Aldeghi, Vytautas Gapsys, Bert L de Groot
ACS Central Science|September 5, 2019
Predicting Kinase Inhibitor Resistance: Physics-Based and Data-Driven ApproachesMatteo Aldeghi, Vytautas Gapsys, Bert L de Groot
Journal of Molecular Biology|February 14, 2012
Driving forces and structural determinants of steric zipper peptide oligomer formation elucidated by atomistic simulationsDirk Matthes, Vytautas Gapsys, Bert L de Groot
Methods in Molecular Biology (Clifton, N.J.)|October 10, 2018
Accurate Calculation of Free Energy Changes upon Amino Acid MutationMatteo Aldeghi, Bert L de Groot, Vytautas Gapsys
Plos Computational Biology|May 10, 2013
Probing the energy landscape of activation gating of the bacterial potassium channel KcsATobias Linder, Bert L de Groot, Anna Stary-Weinzinger
Nature Communications|November 28, 2019
Molecular mechanism of a potassium channel gating through activation gate-selectivity filter couplingWojciech Kopec, Brad S Rothberg, Bert L de Groot
Biophysical Journal|August 20, 2024
Effect of two activators on the gating of a K<sub>2P</sub> channelEdward Mendez-Otalvaro, Wojciech Kopec, Bert L de Groot
Handbook of Experimental Pharmacology|December 20, 2008
Dynamics and energetics of permeation through aquaporins. What do we learn from molecular dynamics simulations?Jochen S Hub, Helmut Grubmüller, Bert L de Groot
Angewandte Chemie (International Ed. in English)|May 25, 2005
Molecular dynamics simulations of protein G challenge NMR-derived correlated backbone motionsOliver F Lange, Helmut Grubmüller, Bert L de Groot
Pageof 21