Anti-COVID-19 terpenoid from marine sources: A docking, admet and molecular dynamics study
Nayim Sepay, S. Aishwarya, Umesh Chandra Halder, Abdullah Alarifi, Mohd Afzal
Topics & Concepts
ChemistryDocking (animal)EnzymeTerpenoidMolecular dynamicsCoronavirus disease 2019 (COVID-19)ProteaseStereochemistrySevere acute respiratory syndrome coronavirus 2 (SARS-CoV-2)NS3BiochemistryCombinatorial chemistryComputational biologyComputational chemistryInfectious disease (medical specialty)BiologyDiseasePathologyNursingMedicineComputational Drug Discovery MethodsDiverse Scientific Research StudiesEnzyme function and inhibition