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Journal of the American Chemical Society|February 1, 2013
Evidence for cardiolipin binding sites on the membrane-exposed surface of the cytochrome bc1Clement Arnarez, Jean-Pierre Mazat, Juan Elezgaray, et al.The Journal of Physical Chemistry Letters|November 21, 2019
An Allosteric Pathway in Copper, Zinc Superoxide Dismutase Unravels the Molecular Mechanism of the G93A Amyotrophic Lateral Sclerosis-Linked MutationPaulo C T Souza, Sebastian Thallmair, Siewert J Marrink, et al.Nature Communications|November 11, 2016
Coupled binding mechanism of three sodium ions and aspartate in the glutamate transporter homologue GltTkAlbert Guskov, Sonja Jensen, Ignacio Faustino, et al.ACS Chemical Biology|January 6, 2021
Semiprocessive Hyperglycosylation of Adhesin by Bacterial Protein N-GlycosyltransferasesLiubov Yakovlieva, Carlos Ramírez-Palacios, Siewert J Marrink, et al.Journal of Chemical Information and Modeling|April 22, 2021
Asymmetric CorA Gating Mechanism as Observed by Molecular Dynamics SimulationsMariia Nemchinova, Josef Melcr, Tsjerk A Wassenaar, et al.Molecules (Basel, Switzerland)|November 29, 2017
Alcohol Interactions with Lipid BilayersTomáš Kondela, Jana Gallová, Thomas Hauß, et al.The Journal of Physical Chemistry. B|July 3, 2018
Transferable MARTINI Model of Poly(ethylene Oxide)Fabian Grunewald, Giulia Rossi, Alex H de Vries, et al.Frontiers in Molecular Biosciences|April 15, 2021
Perspectives on High-Throughput Ligand/Protein Docking With Martini MD SimulationsPaulo C T Souza, Vittorio Limongelli, Sangwook Wu, et al.Journal of Chemical Theory and Computation|June 23, 2020
Coupling Coarse-Grained to Fine-Grained Models via Hamiltonian Replica ExchangeYang Liu, Weria Pezeshkian, Jonathan Barnoud, et al.Journal of the American Chemical Society|June 12, 2012
Structural determinants of the supramolecular organization of G protein-coupled receptors in bilayersXavier Periole, Adam M Knepp, Thomas P Sakmar, et al.Pageof 56