Frigini, Ezequiel N., Rodolfo D. Porasso, Tamás Beke-Somfai, José Javier López Cascales, Ricardo D. Enriz, and Sergio Pantano. 2023. “The Mechanism Of Antimicrobial Small-Cationic Peptides From Coarse-Grained Simulations”. Journal Of Chemical Information And Modeling 63 (21): 6877-6889. doi:10.1021/acs.jcim.3c01348.
Computer Science Applications
Wacha, András, Zoltán Varga, and Tamás Beke-Somfai. 2023. “Comparative Study Of Molecular Mechanics Force Fields For Β-Peptidic Foldamers: Folding And Self-Association”. Journal Of Chemical Information And Modeling 63 (12). American Chemical Society (ACS): 3799-3813. doi:10.1021/acs.jcim.3c00175.
Wacha, András, and Justin A. Lemkul. 2023. “Charmm2Gmx: An Automated Method To Port The Charmm Additive Force Field To Gromacs”. Journal Of Chemical Information And Modeling 63 (14). American Chemical Society (ACS): 4246-4252. doi:10.1021/acs.jcim.3c00860.
Ábrahám, Ágnes, Flavio Massignan, Gergő Gyulai, Miklós Katona, Nóra Taricska, and Éva Kiss. 2022. “Comparative Study Of The Solid-Liquid Interfacial Adsorption Of Proteins In Their Native And Amyloid Forms”. International Journal Of Molecular Sciences 23 (21). MDPI AG: 13219. doi:10.3390/ijms232113219.
Papp, Dóra, Imola Cs. Szigyártó, Bengt Nordén, Andras Perczel, and Tamás Beke-Somfai. 2021. “Structural Water Stabilizes Protein Motifs In Liquid Protein Phase: The Folding Mechanism Of Short Β-Sheets Coupled To Phase Transition”. International Journal Of Molecular Sciences 22 (16). MDPI AG: 8595. doi:10.3390/ijms22168595.
Quemé-Peña, Mayra, Tünde Juhász, Gergely Kohut, Maria Ricci, Priyanka Singh, Imola Cs. Szigyártó, Zita I. Papp, Lívia Fülöp, and Tamás Beke-Somfai. (01/2021AD) 2021. “Membrane Association Modes Of Natural Anticancer Peptides: Mechanistic Details On Helicity, Orientation, And Surface Coverage”. International Journal Of Molecular Sciences 22 (16). MDPI AG. doi:10.3390/ijms22168613.
Pothoff, Jan, Krzysztof Kamil Bojarski, Gergely Kohut, Agnieszka G Lipska, Adam Liwo, Efrat Kessler, Sylvie Ricard-Blum, and Sergey A. Samsonov. 2019. “Analysis Of Procollagen C-Proteinase Enhancer-1/Glycosaminoglycan Binding Sites And Of The Potential Role Of Calcium Ions In The Interaction”. International Journal Of Molecular Sciences 20 (20). MDPI AG: 5021. doi:10.3390/ijms20205021.