Molecular docking studies, molecular dynamics and ADME/tox reveal therapeutic potentials of STOCK1N-69160 against papain-like protease of SARS-CoV-2
Olusola Olalekan Elekofehinti, Opeyemi Iwaloye, Sunday Solomon Josiah, Akeem O. Lawal, Moses Orimoloye Akinjiyan, Esther Opeyemi Ariyo
Topics & Concepts
ADMEDocking (animal)ProteaseChemistryPolyproteinsAmino acidMolecular dynamicsPapainDrugBiochemistryStereochemistryVirologyPharmacologyBiologyEnzymeComputational chemistryMedicineNursingComputational Drug Discovery MethodsSARS-CoV-2 and COVID-19 ResearchDiverse Scientific Research Studies