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.
Library and Information Sciences
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.