RARE-EARTH elements in the topsoils of a Russian industrial city: Sources and human health risk assessment.

Research on rare-earth elements (REEs) in urban soils of Russian industrial cities is extremely limited. This study investigates the potential sources and human health risks of REEs contained in the topsoils of the industrial Russian city of Chelyabinsk. The study also takes into account natural sources of REE as the city is located on the border of granites (Urals) and sedimentary rocks (Western Siberia).

Cyclic Thermomechanical Loading of Epoxy Polymer: Modeling with Consideration of Stress Accumulation and Experimental Verification.

Developing a viscoelastic model for the cyclic thermomechanical loading of thermosetting polymers is the main goal of this study. The model includes memory for residual thermal stresses and can consider stress accumulation across many loading cycles. By considering stress accumulation, we can improve predictions and understand how thermosetting polymers' stress-strain state changes under cyclic thermomechanical loading.

Metamagnetism and canted antiferromagnetic ordering in two monomeric Co complexes with 1-(2-pyrimidyl)piperazine. Hirshfeld surface analysis and theoretical studies.

Here we present the magnetic properties of two cobalt complexes formulated as: [Co(SCN)(L)] (1) and (HL)[Co(SCN)]·HO (2) (L = 1-(2-pyrimidyl)piperazine). The two compounds contain isolated tetrahedral Co complexes with important intermolecular interactions that lead to the presence of a canted antiferromagnetic order below 11.5 and 10.

Managing urban agglomeration processes in Russia in the context of agglomerative and socio-economic development.

Studies on urban agglomeration typically focus on the management of urban agglomerations as special types of spatial organization. The problem of finding an adequate management model which accounts for the level of spatial connectivity and socio-economic development of a given territory remains in the background. This article identifies urban agglomeration management models in Russia which account for the agglomerative and socio-economic development of a given territory.

Physicochemical assessment of ammonium adsorption using a palm shell-based adsorbent activated with acetic acid: experimental and theoretical studies.

The adsorption of ammonium from water was studied on an activated carbon obtained using raw oil palm shell and activated with acetic acid. The performance of this adsorbent was tested at different operating conditions including the solution pH, adsorbent dosage, and initial ammonium concentration. Kinetic and equilibrium studies were carried out, and their results were analyzed with different models.

Effect of a halogen bond on the crystal structure of terphenyldicarboxylic acid derivatives.

The syntheses and structures of dimethyl [1,2:2,3-terphenyl]-1,3-dicarboxylate (1), dimethyl 2,2-diiodo[1,2:2,3-terphenyl]-1,3-dicarboxylate (2), potassium [1,2:2,3-terphenyl]-1,3-dicarboxylate (3) and dimethyl [1,1'-biphenyl]-4,4'-dicarboxylate (4) are reported. Neighboring phenyl rings in compounds 1, 3 and 4 have a planar structure (torsion angles are 0.6-4.

An improved finegrained ciphertext policy based temporary keyword search on encrypted data for secure cloud storage.

We present a temporary keyword search over sensitive and confidential health data in a cloud environment. The cloud constitutes a semi-trusted domain, making it necessary for data owners to secure their data before outsourcing it through techniques like encryption. Attribute-based keyword search techniques tend to perform a search operation using a search token generated by an authorized user.

Single-cell profile reveals the landscape of cardiac immunity and identifies a cardio-protective Ym-1 neutrophil in myocardial ischemia-reperfusion injury.

Myocardial ischemia-reperfusion injury (MIRI) is a major hindrance to the success of cardiac reperfusion therapy. Although increased neutrophil infiltration is a hallmark of MIRI, the subtypes and alterations of neutrophils in this process remain unclear. Here, we performed single-cell sequencing of cardiac CD45 cells isolated from the murine myocardium subjected to MIRI at six-time points.

Biopreservative and Anti-Mycotoxigenic Potentials of MG847589 and Its Bacteriocin in Soft White Cheese.

Probiotics and their bacteriocins have increasingly attracted interest for their use as safe food preservatives. This study aimed to produce soft white cheese fortified with MG847589 ( MG847589) and/or its bacteriocin; cheese with (CP), cheese with bacteriocin (CB), and cheese with both and bacteriocin (CPB) were compared to control cheese (CS) to evaluate their biopreservative and anti-mycotoxigenic potentials for prolonged shelf life and safe food applications. The effects of these fortifications on physiochemical, microbial, texture, microstructure, and sensory properties were studied.

Synthesis, X-ray crystallography, computational investigation on quinoxaline derivatives as potent against adenosine receptor A2AAR.

Quinoxaline represents one of the most important classes of heterocyclic compounds, which have exhibited a wide range of biological activities and industrial importance in many different fields. In this regard, we have synthetized two new quinoxaline derivatives. Their structures were confirmed by single-crystal X-ray analysis.

Heatwaves in Peninsular Malaysia: a spatiotemporal analysis.

One of the direct and unavoidable consequences of global warming-induced rising temperatures is the more recurrent and severe heatwaves. In recent years, even countries like Malaysia seldom had some mild to severe heatwaves. As the Earth's average temperature continues to rise, heatwaves in Malaysia will undoubtedly worsen in the future.

Zero-waste preparation of mixed oxides for submicromolar sensing of Bentazone pesticide.

Necessity of having simple selective and robust methods for the analysis of environmentally relevant chemicals stimulates the development of new approaches to material preparation. Electrochemical sensing using electroactive substrates has proved efficient in the analysis of a wide range of pesticides and is widely used as a routine analytical method. Recently, mixed oxides showed promising electrocatalytic activity toward hazardous substrates.

Effect of Thermal Aging on Viscoelastic Behavior of Thermosetting Polymers under Mechanical and Cyclic Temperature Impact.

Development of load-bearing fiber reinforced plastic (hereinafter referred to as FRP) composite structures in civil engineering, exploited under high temperatures, such as industrial chimneys and gas ducts, requires the knowledge of their long-term behavior under constant and cyclic mechanical and temperature loads. Such conditions mean that the viscoelasticity of FRP should be considered along with the thermal aging effect. This research is devoted to the effects of thermal aging on the viscoelastic behavior of polymers.

High-Energy-Density Material with Magnetically Modulated Ignition.

Preparation of a redox-frustrated high-energy-density energetic material is achieved by gentle protolysis of Mn[N(SiMe)] with the perchlorate salt of the tetrazolamide [HNBuMeTz]ClO (Tz = tetrazole), yielding the MnN hexagonal prismatic cluster, Mn(μ-NTzBuMe)(ClO). Quantum mechanics-based molecular dynamics simulations of the decomposition of this molecule predict that magnetic ordering of the Mn ions influences the pathway and rates of decomposition, suggesting that the initiation of decomposition of the bulk material might be significantly retarded by an applied magnetic field. We report here experimental tests of the prediction showing that the presence of a 0.

Computational analysis of bio-convective eyring-powell nanofluid flow with magneto-hydrodynamic effects over an isothermal cone surface with convective boundary condition.

Non-Newtonian fluids are essential in situations where heat and mass transfer are involved. Heat and mass transfer processes increase efficiency when nanoparticles are added to these fluids. The present study implements a computational approach to investigate the behavior of non-Newtonian nanofluids on the surface of an upright cone.

Insights into the crystal structure investigation and virtual screening approach of quinoxaline derivatives as potent against c-Jun N-terminal kinases 1.

Quinoxaline derivatives are an important class of heterocyclic compounds in which N replaces one or more carbon atoms of the naphthalene ring and exhibit a wide spectrum of biological activities and therapeutic applications. As a result, we were encouraged to explore a new synthetic approach to quinoxaline derivatives. In this work, we synthesized two new derivatives namely, ethyl 4-(2-ethoxy-2-oxoethyl)-3-oxo-3,4-dihydroquinoxaline-2-carboxylate () and 3-oxo-3,4-dihydroquinoxaline-2-carbohydrazide () respectively.

XRD/DFT, Hirshfeld surface analysis and molecular modelling simulations for unfolding reactivity of newly synthesized vanillin derivatives: excellent optical, NLO and protein binding efficiency.

New vanillin derivatives, namely, ethyl (4-formyl-2-methoxyphenoxy)acetate and 2-(4-formyl-2-methoxyphenoxy)--phenylacetamide , respectively, were synthesized and characterized by NMR (H and C), IR, mass spectra and confirmed by single-crystal X-ray analysis. Hirshfeld surface (HS) analysis was performed to probe intra- and intermolecular interactions and surface reactivity. 2D fingerprint plots (FP) were used to study the nature and percentage contribution of intermolecular interactions leading to the formation of the crystal unit.

Design, Virtual Screening, Molecular Docking, ADME and Cytotoxicity Studies of 1,3,5-Triazine Containing Heterocyclic Scaffolds as Selective BRAF Monomeric, Homo and Heterodimeric Inhibitors.

Background: v-RAF murine sarcoma viral homolog B1 (BRAF) is one of the most frequently mutated kinases in human cancers. BRAF exhibits three classes of mutations: Class I monomeric mutants (BRAFV600), class II BRAF homodimer mutants (non-V600), and class III BRAF heterodimers (non-V600).

Method: In this manuscript, the protein-ligand interaction site of all three mutants: BRAF monomer, BRAF homodimer BRAF2:14-3-32, and BRAF heterodimer BRAF:14-3-32:MEK (Mitogen extracellular Kinase) has been discussed.

Injecting hope: chitosan hydrogels as bone regeneration innovators.

Spontaneous bone regeneration encounters substantial restrictions in cases of bone defects, demanding external intervention to improve the repair and regeneration procedure. The field of bone tissue engineering (BTE), which embraces a range of disciplines, offers compelling replacements for conventional strategies like autografts, allografts, and xenografts. Among the diverse scaffolding materials utilized in BTE applications, hydrogels have demonstrated great promise as templates for the regeneration of bone owing to their resemblance to the innate extracellular matrix.

Enhancement of intermolecular aggregation on solvent-influenced strong hydrogen-bonded single crystal.

The intermolecular aggregation between the solvent and organic molecules is covered in the current article. 4,4'-(Buta-1,3-diyne-1,4-diyl)dibenzoic acid (DADBA) was used as an organic molecule and dimethyl sulfoxide (DMSO) as a solvent to create the target compound DADBA-DMSO. The material's hydrogen bonding and intermolecular aggregation were determined by appropriate characterization methods, including single-crystal X-ray diffraction (XRD), Fourier-transform infrared (FTIR), photoluminescence (PL), and cyclic voltammetry (CV) analysis.