Theoretical study of extrinsic fluorescence probe reacting with volatile organic compounds
Theoretical study of extrinsic fluorescence probe reacting with volatile organic compounds
复制标题
外源荧光探针与挥发性有机物反应的理论研究
DOI：
10.1166/mex.2018.1408
复制
发表时间：
2018-02
影响因子：
0.7
通讯作者：
Xu Haixia
中科院分区：
文献类型：
--
作者：
Gu Haiyang;Shi Hairong;Sun Yanhui;Xu Haixia
A novel sensor-based method named extrinsic fluorescence probe (EFP) has been developed to detect and evaluate food quality and food security with low-cost, sensitive, rapid and simple advantages. Theoretical study using density functional theory (DFT) at B3LYP/LANL2DZ level was carried out to investigate the ability of EFP sensor binding VOCs. SnP is selected to represent EFP sensor because of its importance in EFP system. The binding energies relating to the process of SnP reacting with VOCs were obtained by subtracting the before-reaction energy from the after-reaction energy for each model. The binding energies for all models were classified into three groups that will be helpful in the further sensor design to detect and evaluate food quality and food security. Furthermore, this study also suggests that the theoretical study is useful for the optimization of similar EFP sensor.
