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Scientific Reports|June 24, 2021
Insights into the substrate binding mechanism of SULT1A1 through molecular dynamics with excited normal modes simulationsBalint Dudas, Daniel Toth, David Perahia, et al.Journal of Chemical Theory and Computation|June 11, 2026
Adaptive Normal Mode Sampling (aMDeNM) Enhances Exploration of Protein Conformational Space and Reveals the Functional Role of Frequency CouplingPedro T Resende-Lara, Maurício G S Costa, Balint Dudas, et al.Frontiers in Molecular Biosciences|February 2, 2023
Small GTPase Ran: Depicting the nucleotide-specific conformational landscape of the functionally important C-terminusJanka Czigleczki, Pedro Tulio de Resende Lara, Balint Dudas, et al.Journal of Chemical Theory and Computation|July 17, 2023
Investigating the Unbinding of Muscarinic Antagonists from the Muscarinic 3 ReceptorPedro J Buigues, Sascha Gehrke, Magd Badaoui, et al.Journal of the American Chemical Society|July 13, 2026
Nature Counts to Three: Universal Mg-Pinch Motif Polarizes the Cleaved Bond in NTP-Processing EnzymesBalint Dudas, Dénes Berta, Pablo Jambrina, et al.Frontiers in Molecular Biosciences|February 21, 2022
Sampling of Protein Conformational Space Using Hybrid Simulations: A Critical Assessment of Recent MethodsBurak T Kaynak, James M Krieger, Balint Dudas, et al.Pageof 2