شماره ركورد كنفرانس :
3834
عنوان مقاله :
Functionalized Boron Nitride Nanotube as Nanovector for Drug Delivery of Collagen Amino Acids: a density functional approach
پديدآورندگان :
Hamedani Shahla sh_hamedani2004@yahoo.com Department of Chemistry, Abhar Branch, Islamic Azad University, Abhar, Iran; , Felegari Zahra Department of Chemistry, Science and Research Branch, Islamic Azad University, Tehran, Iran
كليدواژه :
Collagen amino acids , Boron nitride nanotube , Interaction , DFT
عنوان كنفرانس :
نوزدهمين سمينار شيمي فيزيك ايران
چكيده فارسي :
We perform Density Functional Theory studies for investigate the interaction of collagen amino acids with (5,5) armchair and (8, 0) zigzag boron nitride nanotubes (BNNTs). Based on calculated results, the BNNTs can act as a suitable drug delivery vehicle of amino acids in biological systems. Our study results indicated that the adsorption and solvation energies were negative for (5,5)/(8,0) BNNTs–amino acid complexes implying the thermodynamic favorability and spontaneous interactions of amino acids with BNNTs sidewall. These results were very relevant in order to detect the potential applications of functionalized BNNTs as drug delivery systems
