Design of novel viral attachment inhibitors of the spike glycoprotein (S) of severe acute respiratory syndrome coronavirus-2 (SARS-CoV-2) through virtual screening and dynamics
Arafat Rahman Oany, Mamun Mia, Tahmina Pervin, Md. Junaid, S. M. Zahid Hosen, Mohammad Ali Moni
Topics & Concepts
PubChemVirtual screeningLipinski's rule of fiveDrugDocking (animal)ADMEPharmacologyChemistryIn vivoBioavailabilityCoronavirusIn silicoLead compoundSevere acute respiratory syndrome coronavirus 2 (SARS-CoV-2)In vitroCoronavirus disease 2019 (COVID-19)Computational biologyDrug discoveryMedicineBiochemistryBiologyGeneBiotechnologyDiseasePathologyNursingInfectious disease (medical specialty)SARS-CoV-2 and COVID-19 ResearchComputational Drug Discovery MethodsBacteriophages and microbial interactions