Nano drug delivery study of anticancer properties on jackfruit using QM/MM methods

Abstract

Nano-biotechnology takes most of its fundamentals from nanotechnology which most of the equipment designed for nano-biotechnological are based on other existing nanotechnologies. Nano-biotechnology is often used to describe the overlapping multidisciplinary activities associated with chemistry, biology and nano-medicine. In this investigation, the ab initio calculations were implemented using Gaussian program package based on density functional level of theory (DFT) to achieve the drug delivery technic for unraveling of linkage of Jackfruit to single walled carbon nanotubes. NMR investigation gives deeper physical insight into the impact of different structures. In this work NMR parameters were calculated at the Ethyl isovalerate, Propylisovalerate, Isobutyl isovalerate and 3-methyl butyl acetate extracted of Jackfruit with different functional groups in their active sites so, the anticancer properties of this compound have been clarified.