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Nature Communications|January 11, 2022
Polyply; a python suite for facilitating simulations of macromolecules and nanomaterialsFabian Grünewald, Riccardo Alessandri, Peter C Kroon, et al.The Journal of Physical Chemistry. B|September 10, 2016
Ganglioside-Lipid and Ganglioside-Protein Interactions Revealed by Coarse-Grained and Atomistic Molecular Dynamics SimulationsRuo-Xu Gu, Helgi I Ingólfsson, Alex H de Vries, et al.Angewandte Chemie (International Ed. in English)|February 5, 2015
Enantioselective enzymes by computational design and in silico screeningHein J Wijma, Robert J Floor, Sinisa Bjelic, et al.Journal of the American Chemical Society|February 18, 2017
Bulk Heterojunction Morphologies with Atomistic Resolution from Coarse-Grain Solvent Evaporation SimulationsRiccardo Alessandri, Jaakko J Uusitalo, Alex H de Vries, et al.Journal of Chemical Information and Modeling|January 17, 2025
Systematic Approach to Parametrization of Disaccharides for the Martini 3 Coarse-Grained Force FieldAstrid F Brandner, Iain P S Smith, Siewert J Marrink, et al.Physical Chemistry Chemical Physics : PCCP|October 23, 2012
Interaction of C70 fullerene with the Kv1.2 potassium channelLuca Monticelli, Jonathan Barnoud, Adam Orlowski, et al.Computational and Structural Biotechnology Journal|October 11, 2021
A structural view onto disease-linked mutations in the human neutral amino acid exchanger ASCT1Pavlo Stehantsev, Artem Stetsenko, Mariia Nemchinova, et al.Biochimica Et Biophysica Acta. Biomembranes|August 9, 2019
Two distinct anionic phospholipid-dependent events involved in SecA-mediated protein translocationSabrina Koch, Marten Exterkate, Cesar A López, et al.Biophysical Journal|April 26, 2018
Molecular Dynamics of the Association of L-Selectin and FERM Regulated by PIP2Fude Sun, Carsten F E Schroer, Lida Xu, et al.Physical Review Letters|March 5, 2009
3D pressure field in lipid membranes and membrane-protein complexesO H Samuli Ollila, H Jelger Risselada, Martti Louhivuori, et al.Pageof 2,411