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Journal of Chemical Information and Modeling|September 8, 2021
Modeling Protein-Glycosaminoglycan Complexes: Does the Size Matter?Mateusz Marcisz, Martin Zacharias, Sergey A Samsonov
Beilstein Journal of Organic Chemistry|January 3, 2024
Studying specificity in protein-glycosaminoglycan recognition with umbrella samplingMateusz Marcisz, Sebastian Anila, Margrethe Gaardløs, et al.
Journal of Chemical Information and Modeling|March 29, 2023
Solvent Model Benchmark for Molecular Dynamics of GlycosaminoglycansMateusz Marcisz, Sergey A Samsonov
Journal of Computational Chemistry|July 7, 2022
Explicit solvent repulsive scaling replica exchange molecular dynamics (RS-REMD) in molecular modeling of protein-glycosaminoglycan complexesMateusz Marcisz, Margrethe Gaardløs, Krzysztof K Bojarski, et al.
Journal of Computational Chemistry|March 26, 2021
Evaluation of replica exchange with repulsive scaling approach for docking glycosaminoglycansMartyna Maszota-Zieleniak, Mateusz Marcisz, Małgorzata M Kogut, et al.
Current Opinion in Structural Biology|February 13, 2022
Modeling glycosaminoglycan-protein complexesMałgorzata M Kogut, Mateusz Marcisz, Sergey A Samsonov
Methods in Molecular Biology (Clifton, N.J.)|January 20, 2023
Repulsive Scaling Replica Exchange Molecular Dynamics in Modeling Protein-Glycosaminoglycan ComplexesMateusz Marcisz, Martyna Maszota-Zieleniak, Sergey A Samsonov
Glycobiology|March 8, 2021
Further analyses of APRIL/APRIL-receptor/glycosaminoglycan interactions by biochemical assays linked to computational studiesMateusz Marcisz, Bertrand Huard, Agnieszka G Lipska, et al.
Biomolecules|September 28, 2021
Advanced Molecular Dynamics Approaches to Model a Tertiary Complex APRIL/TACI with Long GlycosaminoglycansMateusz Marcisz, Martyna Maszota-Zieleniak, Bertrand Huard, et al.
Physical Chemistry Chemical Physics : PCCP|January 30, 2021
Computational insights into the role of calcium ions in protein-glycosaminoglycan systemsMałgorzata M Kogut, Martyna Maszota-Zieleniak, Mateusz Marcisz, et al.
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