Mechanism of Inhibition of SARS-CoV-2 M pro by N3 Peptidyl Michael Acceptor Explained by QM/MM Simulations and Design of New Derivatives with Tunable Chemical Reactivity
Arafet, Kemel, Serrano Aparicio, Natalia, Lodola, Alessio, Mulholland, Adrian John, González, Florenci Vicent, Åwiderek, Katarzyna, Moliner, VicentYear:
2021
Journal:
Chemical Science
DOI:
10.1039/D0SC06195F
File:
PDF, 2.02 MB
2021