DFT study of Ti <sub>3</sub> C <sub>2</sub> MXene nanosheets as a drug delivery system for 5-fluorouracil
Maryam Sadeghi, Bahram Khoshnevisan
Abstract
surface without any substantial change in the structural properties. This study could provide a deep understanding of the interaction mechanism of 2-dimensional (2D) MXene materials with drugs at the atomistic scale and have an important contribution to the discovery and application of novel 2D materials as drug delivery systems.
Topics & Concepts
Density functional theoryDrug deliveryDrugMoleculeAnticancer drugFluorouracilMaterials scienceComputational chemistryChemistryNanotechnologyPharmacologyOrganic chemistryCancerMedicineInternal medicineMXene and MAX Phase Materials2D Materials and ApplicationsBoron and Carbon Nanomaterials Research