RESUMEN

In this work, spin-polarized density functional theory calculations are conducted to evaluate the possible applicability of a single Si atom doped boron nitride graphyne-like nansoheet (Si@BN-yne) for reduction of nitrous oxide (N2O). The calculations show that Si-doping in BN graphene is energetically favorable, and the resulting Si@BN-yne is both dynamically and thermodynamically stable. According to our findings, N2O spontaneously dissociates when it interacts with the Si@BN-yne from its O site without the need for an energy barrier, releasing 2.89 eV of energy. The adsorption energy of CO molecule on the Si@BN-yne is less negative than that of N2O, implying that N2O will predominately occupy the catalyst surface. The CO + Oad reaction is used to remove the remaining oxygen atom (Oad) from the Si@BN-yne surface. The calculations show that the reaction proceeds through a low energy barrier of 0.05 eV, which is much lower than the previously reported catalysts. This demonstrates the high catalytic activity of Si@BN-yne nanosheet. Furthermore, the adsorption of H2O and O2 species on the Si@BN-yne nanosheet is investigated. The results show that the presence of these species has no effect on the catalytic activity of the Si@BN-yne for N2O reduction. These results show that the proposed novel Si@BN-yne catalyst can be regarded as an efficient material in the development of promising active catalysts for N2O elimination from the environment.

RESUMEN

As the prevalence of microbial keratitis increases, it creates an environment conducive to genotoxicity response. A potential connection between growth arrest and DNA-damage-inducible 45 gamma (GADD45G) gene expression has not been proven in the corneal epithelial cells. The aim of this study was to determine whether lipopolysaccharide (LPS) enhances genotoxicity, DNA damage, and inflammatory responses in human corneal epithelial cells (HCECs) in vitro. In a set of parameters, cytotoxicity, reactive oxygen species, mitochondrial membrane potential, DNA damage, inflammatory response, and apoptosis were assessed. LPS (1, 5, and 10 µg/mL) treated HCECs were increased reactive oxygen species formation, mitochondrial membrane depolarization, and genotoxicity in a concentration-dependent manner. Similarly, NF-κB, PARP1, and TP53 were also overexpressed in the LPS treated HCECs. 24 hours after LPS induction, micronucleus scoring, and proapoptotic factors were also increased. Among them, the GADD45G, NF-κB, and γH2AX were overexpressed both on the mRNA and protein levels in LPS (10 µg/mL) treated HCECs. In our study, we show that the GADD45G signaling can trigger genotoxic instability in HCECs exposed to LPS. Therefore, understanding the factors contributing to infectious keratitis, such as GADD45G, NF-κB, and γH2AX signaling, may help to develop antigenotoxic and anti-inflammatory therapies for corneal dystrophy and epithelial cell remodeling.

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RESUMEN

We report a non-enzymatic facile method for the detection of L-cysteine (L-Cyst) using free-standing TiO2 nanotube (TNT) array-modified glassy carbon electrodes (GCEs). Self-organized, highly ordered, and vertically oriented TNT arrays were fabricated by anodization of titanium sheets in ethylene glycol-based electrolyte. Detailed electrochemical measurements were performed and it was found that modified GCE exhibited high current compared to the pristine counterpart. The high current of the modified electrode was attributed to the high surface area and enhanced electrocatalytic activities of the TNTs toward the L-Cyst oxidation. Under the optimum conditions, the modified electrode exhibited a high sensitivity of ∼1.68 µA mM-1 cm-2 with a low detection limit of ∼0.1 mM. The fabricated electrode was found to be sensitive to pH and electrolyte temperature. The real sample analysis of the proposed method showed a decent recovery toward L-Cyst addition in human blood serum. Furthermore, the density-funcational theory (DFT) analysis revealed that TNTs have greater affinity toward L-Cyst, having stronger binding distance after its adsorption. The higher negative E ads values suggested a stable and chemisorption nature. The density of states results show that the E gap of TNTs is significantly reduced after L-Cyst adsorption. The modified GCE showed excellent selectivity, enhanced stability, and fast response, which make TNTs a promising candidate for the enzyme-free detection of other biological analytes.