A dispersion-corrected DFT calculation on encapsulation of favipiravir drug used as antiviral against COVID-19 into carbon-, boron-, and aluminum-nitride nanotubes for optimal drug delivery systems combined with molecular docking simulations
Roqaya Albarakati, Ohoud S. Al−Qurashi, Zaki Safi, Nuha Wazzan
Topics & Concepts
ChemistryBoron nitrideCarbon nanotubeFavipiravirDrug deliveryDrugNanotechnologyCoronavirus disease 2019 (COVID-19)Computational chemistryPharmacologyInfectious disease (medical specialty)Organic chemistryDiseaseMaterials scienceMedicinePathologyBoron and Carbon Nanomaterials ResearchGraphene and Nanomaterials ApplicationsNanoparticles: synthesis and applications