Biophysical, Biochemical, and Molecular Docking Investigations of Anti-Glycating, Antioxidant, and Protein Structural Stability Potential of Garlic.

Garlic has been reported to inhibit protein glycation, a process that underlies several disease processes, including chronic complications of diabetes mellitus. Biophysical, biochemical, and molecular docking investigations were conducted to assess anti-glycating, antioxidant, and protein structural protection activities of garlic. Results from spectral (UV and fluorescence) and circular dichroism (CD) analysis helped ascertain protein conformation and secondary structure protection against glycation to a significant extent. Further, garlic showed heat-induced protein denaturation inhibition activity (52.17%). It also inhibited glycation, advanced glycation end products (AGEs) formation as well as lent human serum albumin (HSA) protein structural stability, as revealed by reduction in browning intensity (65.23%), decrease in protein aggregation index (67.77%), and overall reduction in cross amyloid structure formation (33.26%) compared with positive controls (100%). The significant antioxidant nature of garlic was revealed by FRAP assay (58.23%) and DPPH assay (66.18%). Using molecular docking analysis, some of the important garlic metabolites were investigated for their interactions with the HSA molecule. Molecular docking analysis showed quercetin, a phenolic compound present in garlic, appears to be the most promising inhibitor of glucose interaction with the HSA molecule. Our findings show that garlic can prevent oxidative stress and glycation-induced biomolecular damage and that it can potentially be used in the treatment of several health conditions, including diabetes and other inflammatory diseases

Synthetic, Mesomorphic, and DFT Investigations of New Nematogenic Polar Naphthyl Benzoate Ester Derivatives

Four new non-symmetrical derivatives based on central naphthalene moiety, 4-((4–(alkoxy)phenyl) diazenyl)naphthalen–1–yl 4–substitutedbenzoate (In/x), were prepared, and their properties were investigated experimentally and theoretically. The synthesized materials bear two wing groups: an alkoxy chain of differing proportionate length (n = 6 and 16 carbons) and one terminal attached to a polar group, X. Their molecular structures were elucidated via elemental analyses and FT-IR and NMR spectroscopy. Differential scanning calorimetry (DSC) and polarized optical microscopy (POM) were carried out to evaluate their mesomorphic properties. The results of the experimental investigations revealed that all the synthesized analogues possess only an enantiotropic nematic (N) mesophase with a high thermal stability and broad range. Density functional theory (DFT) calculations were in accordance with the experimental investigations and revealed that all prepared materials are to be linear and planar. Moreover, the rigidity of the molecule increased when an extra fused ring was inserted into the center of the structural shape, so its thermal and geometrical parameters were affected. Energy gap predictions confirmed that the I16/c derivative is more reactive than other compounds

Induced Nematic Phase of New Synthesized Laterally Fluorinated Azo/Ester Derivatives

A new series of laterally fluorinated mesomorphic compounds, namely 2-fluoro-4-((4-(alkyloxy)phenyl)diazenyl)phenyl 4-substitutedbenzoate (Inx) were prepared and evaluated for their mesophase behavior. The synthesized series constitutes five members that possess different terminally attached polar groups (X). Their molecular structures were confirmed by elemental analyses and both FT-IR and NMR spectroscopy. Examination of the prepared derivatives was conducted via experimental and theoretical tools. Mesomorphic investigations were carried by polarized optical microscopy (POM) and differential scanning calorimetry (DSC). DSC and POM measurements indicated that except for the un-substituted analogue, all other derivatives were purely nematogenic, possessing their nematic (N) mesophase enantiotropically. This is to say that insertions of terminal polar substituents on their mesogenic structures induced the N phase. In addition, the location of lateral and terminal polar moieties played a considerable role in achieving good thermal N stability. Computational calculations were investigated to determine the deduced optimized molecular structures. Theoretical data indicated that both size and polarity of the terminal substituent (X) have essential impact on the thermal parameters and optical properties of possible geometries

Design of Liquid Crystal Materials Based on Palmitate, Oleate, and Linoleate Derivatives for Optoelectronic Applications

Herein, liquid crystalline derivatives based on palmitate, oleate, and linoleate moieties with azomethine cores were synthesized, and their physical, chemical, optical, and photophysical properties were investigated in detail. The mesomorphic activity of these materials was examined through polarized optical microscopy (POM) and differential scanning calorimetry (DSC). The observed results revealed that the stability of the thermal mesophase depends on the terminal polar as well as on the fatty long-chain substituents. Purely smectogenic phases were detected in all three terminal side chains. A eutectic composition with a low melting temperature and a broad smectic A range was found by constructing a binary phase diagram and addressing it in terms of the mesomorphic temperature range. The energy bandgap of the palmitate-based derivative (Ia) was determined as 3.95 eV and slightly increased to 4.01 eV and 4.05 eV for the oleate (Ib) and linoleate (Ic) derivatives, respectively. The optical constants (n, κ, εr, and εi) were extracted from the fitting of measured spectroscopic ellipsometer data. The steady-state spectra of these samples exhibited a broad emission in the range 400–580 nm, which was found to be blue shifted to 462 nm for both Ib and Ic derivatives. The average fluorescence decay lifetime of the Ia derivative was found to be 598 ps, which became faster for the Ib and Ic derivatives and slower for the sample with a chloride end polar group

High carbon-resistant nickel supported on yttria–zirconia catalysts for syngas production by dry reforming of methane: The promoting effect of cesium

Dry reforming of methane (DRM) is a highly researched process for conversion of methane into syngas that consumes the greenhouse gas (CO2). In this work, the promotional effect of cesium on yttria-zirconia-supported nickel catalysts is studied, for the first time, in DRM. Cs loading was varied from 0.5 to 4.0 wt% and fresh materials were characterized by N2 sorption, XRD, TPR, and TEM, while spent catalysts were examined by TEM, Raman spectroscopy, and TGA after catalytic testing. Interestingly, cesium improved carbon resistance of the catalysts. It was shown that addition of up to 1.0 wt% Cs resulted in formation of 13–14 nm nanoparticles in strong interaction with the support, which prevented their sintering during reaction. In this case, hydrogen yield exceeded 75% after 420 min on stream, and this value was higher than those reported in literature for the same loading of other promoters like cerium and barium. However, as the amount of cesium surpassed 1.0 wt%, catalytic performance was lowered, even below that of Cs-free sample and this can be assigned to a possible coverage of active sites by excess cesium. An optimum range of 0.5–1.0 wt% was thus determined for a good performance in dry reforming of methane

COx -free H2 Production via Catalytic Decomposition of CH4 over Fe Supported on Tungsten oxide-activated Carbon Catalyst: Effect of Tungsten Loading

Production of COx-free H2 from CH4 (a major global warming contributor) over cheap catalysts is a dominant task for the scientific community to accomplish environmental-friendly clean H2 energy sources. Herein, a tungsten oxide-activated carbon-supported Fe catalyst is prepared by impregnation method, characterized by X-ray diffraction, surface area-porosity measurement, temperature programmed reduction/oxidation and thermogravimetry analysis. 30wt.%Fe supported tungsten oxide incorporated activated carbon catalyst is found superior to 30 wt% Fe supported on activated carbon incorporated tungsten oxide due to higher surface area and high concentration of reducible catalytic active sites. 30wt.%Fe impregnated over 25 wt%WO3-75 wt%activated carbon support catalyst has the highest concentration of reducible surface-active species and it had excellent performance among other tungsten oxide incorporated catalysts. The catalyst showed 66.04% CH4 conversion, 63.12% H2 yield and YH2 /CCH4 > 0.9 initially which didn’t fall below 35 % up to 160-minutes. Improper matching between the rate of carbon formation and the rate of diffusion over a highly crystalline 30Fe50W50Ac catalyst resulted in rapid deactivation

Photocatalytic Degradation of Textile Orange 16 Reactive Dye by ZnO Nanoparticles Synthesized via Green Route Using Punica Granatum Leaf Extract

Since it does not use any dangerous chemicals and is a simple, low-cost process, the green synthesis approach for nanoparticle creation has several benefits compared to the physical and chemical synthesis routes. The current study describes an environmentally friendly synthesis of zinc oxide (ZnO) nanoparticles (NPs) using an extract of Punica granatum plant leaves. Fourier-transform infrared spectroscopy (FTIR), ultraviolet-visible spectrophotometer (UV-Vis), field-emission scanning electron microscopy (FESEM), energy-dispersive X-ray spectroscopy, and X-ray diffraction techniques were used to characterize the morphology, composition, and structural properties of the synthesized zinc oxide nanoparticles. The XRD pattern reveals that the ZnO nanoparticles are crystalline and have a diameter of 20 nm. According to the FESEM studies, the ZnO-NPs have sizes ranging from 50 to 100 nm on average and are almost spherical. When exposed to direct sunlight, the produced ZnO-NPs demonstrate impressive photocatalytic oxidation of textile Orange 16, a reactive dye. As a result, our research advances the development of a green photocatalyst for the removal of harmful dyes from water

Photocatalytic Degradation of Textile Orange 16 Reactive Dye by ZnO Nanoparticles Synthesized via Green Route Using Punica Granatum Leaf Extract

Since it does not use any dangerous chemicals and is a simple, low-cost process, the green synthesis approach for nanoparticle creation has several benefits compared to the physical and chemical synthesis routes. The current study describes an environmentally friendly synthesis of zinc oxide (ZnO) nanoparticles (NPs) using an extract of Punica granatum plant leaves. Fourier-transform infrared spectroscopy (FTIR), ultraviolet-visible spectrophotometer (UV-Vis), field-emission scanning electron microscopy (FESEM), energy-dispersive X-ray spectroscopy, and X-ray diffraction techniques were used to characterize the morphology, composition, and structural properties of the synthesized zinc oxide nanoparticles. The XRD pattern reveals that the ZnO nanoparticles are crystalline and have a diameter of 20 nm. According to the FESEM studies, the ZnO-NPs have sizes ranging from 50 to 100 nm on average and are almost spherical. When exposed to direct sunlight, the produced ZnO-NPs demonstrate impressive photocatalytic oxidation of textile Orange 16, a reactive dye. As a result, our research advances the development of a green photocatalyst for the removal of harmful dyes from water