Conformational transitions upon ligand binding: holo-structure prediction from apo conformations.

por Daniel Seeliger, Bert L de Groot
Publicado 2010

Lipid-protein interactions modulate the conformational equilibrium of a potassium channel

por Ruo-Xu Gu, Bert L. de Groot
Publicado 2020

Molecular mechanism of a potassium channel gating through activation gate-selectivity filter coupling

por Wojciech Kopec, Brad S. Rothberg, Bert L. de Groot
Publicado 2019

Mapping the conformational dynamics and pathways of spontaneous steric zipper Peptide oligomerization.

por Dirk Matthes, Vytautas Gapsys, Venita Daebel, Bert L de Groot
Publicado 2011

Temperature dependence of protein-water interactions in a gated yeast aquaporin

por Camilo Aponte-Santamaría, Gerhard Fischer, Petra Båth, Richard Neutze, Bert L. de Groot
Publicado 2017

In silico assessment of the conduction mechanism of the Ryanodine Receptor 1 reveals previously unknown exit pathways

por Leonard P. Heinz, Wojciech Kopec, Bert L. de Groot, Rainer H. A. Fink
Publicado 2018

Accurate absolute free energies for ligand–protein binding based on non-equilibrium approaches

por Vytautas Gapsys, Ahmet Yildirim, Matteo Aldeghi, Yuriy Khalak, David van der Spoel, Bert L. de Groot
Publicado 2021

A single NaK channel conformation is not enough for non-selective ion conduction

por Chaowei Shi, Yao He, Kitty Hendriks, Bert L. de Groot, Xiaoying Cai, Changlin Tian, Adam Lange, Han Sun
Publicado 2018

A molecular mechanism for transthyretin amyloidogenesis

por Ai Woon Yee, Matteo Aldeghi, Matthew P. Blakeley, Andreas Ostermann, Philippe J. Mas, Martine Moulin, Daniele de Sanctis, Matthew W. Bowler, Christoph Mueller-Dieckmann, Edward P. Mitchell, Michael Haertlein, Bert L. de Groot, Elisabetta Boeri Erba, V. Trevor Forsyth
Publicado 2019