Discovering potent inhibitors against the Mpro of the SARS-CoV-2. A medicinal chemistry approach
Aamir Mehmood, Sadia Nawab, Yanjing Wang, Aman Chandra Kaushik, Dong‐Qing Wei
Topics & Concepts
Docking (animal)Computational biologyMolecular dynamicsProteaseSevere acute respiratory syndrome coronavirus 2 (SARS-CoV-2)Active siteDrugCoronavirus disease 2019 (COVID-19)Combinatorial chemistryChemistryDrug discoveryStereochemistryBiologyPharmacologyEnzymeMedicineBiochemistryComputational chemistryVeterinary medicineInfectious disease (medical specialty)PathologyDiseaseComputational Drug Discovery MethodsSynthesis and biological activitySARS-CoV-2 and COVID-19 Research