PMID-sentid Pub_year Sent_text comp_official_name comp_offsetprotein_name organism prot_offset 32441299-5 2020 Using well-defined computational methods, we identified Glecaprevir and Maraviroc (MVC) as the best inhibitors of SARS-CoV-2 Mpro. glecaprevir 56-67 NEWENTRY Severe acute respiratory syndrome-related coronavirus 125-129 33645457-5 2021 Current study, based on docking and extensive set of MD simulations, finds the combination of Elbasvir, Glecaprevir and Ritonavir to be a viable candidate for further experimental drug testing/pharmacophore design for Mpro.Communicated by Ramaswamy H. Sarma. glecaprevir 104-115 NEWENTRY Severe acute respiratory syndrome-related coronavirus 218-222 32441299-7 2020 Glecaprevir and MVC bind to the conserved residues of substrate-binding pocket of SARS-CoV-2 Mpro. glecaprevir 0-11 NEWENTRY Severe acute respiratory syndrome-related coronavirus 93-97 34986429-5 2022 Molecular dynamics (MD) simulations confirmed the stability of their Mpro complexes, with the MMPBSA binding free energy (DeltaGbind) ranging between -124 kJ/mol (glecaprevir) and -28.2 kJ/mol (velpatasvir). glecaprevir 163-174 NEWENTRY Severe acute respiratory syndrome-related coronavirus 69-73 34986429-8 2022 Glecaprevir and nelfinavir (DeltaGbind = -95.4 kJ/mol) appear to be the most effective antiviral drugs against Mpro. glecaprevir 0-11 NEWENTRY Severe acute respiratory syndrome-related coronavirus 111-115