Computational insights into tetracyclines as inhibitors against SARS-CoV-2 Mpro via combinatorial molecular simulation calculations
Shiv Bharadwaj, Kyung Eun Lee, Vivek Dhar Dwivedi, Sang Gu Kang
Topics & Concepts
MinocyclineDoxycyclineDocking (animal)ChemistryComputational biologyPharmacologyVirologyCombinatorial chemistryAntibioticsMedicineBiologyBiochemistryNursingComputational Drug Discovery MethodsSARS-CoV-2 and COVID-19 ResearchSynthesis and biological activity