English (United Kingdom)

https://curated-unify.zendy.io/wp-json/zendy-region/v1/featured_content/oa?rat=en

https://curated-unify.zendy.io/wp-json/zendy-region/v1/highlighted_journal/

Global: Zendy Plus annual

Presents the access of premium content as premium feature

Premium Content

Presents the keyphrase highlighting as premium feature

Keyphrase Highlighting

Presents the summarisation as premium feature

Summarisation

Insights

Presents the pdf analysis as premium feature

PDF Analysis

Presents the zaia usage as premium feature

ZAIA

Global: Zendy Tools annual

Global: Zendy Free Plan

Global: Zendy Tools monthly

Global: Zendy Plus monthly

Nowadays, the use of nanotube is widely spread in the field of drug delivery. In this work, bind between SWCNT (6, 6) with 5-fluorouracil were investigated using DFT in the gas phase at 298.15K and 1atm. Density function theory parameters were carried out with Gaussian 98 by M062X/6-31G** standard basis set. The NBO analysis and electronic properties have calculated from composites A, B, and C. The calculated magnetic shielding tensor (σiso and σ aniso, ppm) studied for C, H, N, F and O nuclei in the active site of for composites A, B, and C. The results are shown composite C more stable than others. Key word: Carbon nanotube, 5-Fluorouracil, DFT, NBO, NMR.

Quantum Investigation (NMR and Electronic Properties) of SWCNT (6, 6) with 5-Fluorouracil as Nano Carrier