Mechanism of the Covalent Inhibition of Human Transmembrane Protease Serine 2 as an Original Antiviral Strategy
A. Spinello, L. D'Anna, E. Bignon, T. Miclot, S. Grandemange, A. Terenzi, G. Barone, F. Barbault, A. MONARI
This study uses multiscale molecular modeling to investigate the mechanism of TMPRSS2 inhibition by Nafamostat, revealing its free-energy profile and structural dynamics.
bioRxiv · Apr 23, 2023Biophysics