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In this investigation, the experimental FT-IR and FT-Raman spectra of cholesterol in the solid phase and in ethanol solution have been combined with the B3LYP/6–311++G** calculations and the scaled quantum mechanical f...

Zooarchaeology by Mass Spectrometry (ZooMS) is a rapid, low-cost, collagen-based method for the taxonomic identification of animal tissues. It is now increasingly applied to bone fragments from archaeological contexts, c...

Upconversion photodynamic therapy (UC-PDT), which integrates upconversion nanoparticles (UCNPs) with photosensitizers (PSs), presents a promising advancement in the field of phototherapy. However, despite the extensive s...

We report here the virtual screening design, synthesis and activity of eight new inhibitors of SphK1. For this study we used a pre-trained Graph Convolutional Network (GCN) combined with docking calculations. This explor...

Diels-Alder betweennitroalkenes derived from a sugar scaffold and cyclopentadiene were examined.Depending on chemical structure of nitroalkene and polarity of solvent used,the reaction proceeded via the formation of a ni...

This work shows that predicting, using a model, the topology and even the existence range of the critical behavior in an asymmetrical ternary system, is practically impossible without a systematic strategy to build throu...

Abstract When several traditional flow-shop lines operate in parallel, the operation mode with no communication between production lines will no longer be the optimal production paradigm. This paper describes matrix manu...

HoNiSi3 is an intermetallic compound characterized by two successive antiferromagnetic transitions at TN1 = 6.3 K and TN2 = 10.4 K. Here, its zero-field microscopic magnetic structure is inferred from resonant x-ray magn...

Coffee has been a global commodity since its discovery, so it's not surprising that there are various coffee cultivation variations in different regions. Economically, coffee plays a significant role in coffee-producin...