bluuebunny/crossref_metadata_2025 huggingface dataset:
A Novel Cognition of Decitabine: Insights into Immunomodulation and Antiviral Effects
Authors: Xiao Ji , Liu Ping , Wang Yiliang , Zhu Yexuan , Zeng Qiongzhen , Hu Xiao , Ren Zhe , Wang Yifei
Published: March 2022

DNA methylation, as one of the major means of epigenesis change, makes a large difference in the spatial structure of chromatin, transposable element activity and, fundamentally, gene transcription. It has been confirmed that DNA methylation is closely related to innate immune responses. Decitabine, the most efficient available DNA methyltransferase inhibitor, has demonstrated exhilarating immune activation and antiviral effects on multiple viruses, including HIV, HBV, HCV, HPV and EHV1. This review considers the role of decitabine in regulating innate immune responses and antiviral ability. Understanding the complex transcriptional and immune regulation of decitabine could help to identify and validate therapeutic methods to reduce pathogen infection-associated morbidity, especially virus infection-induced morbidity and mortality.
Hydrolysis of the Borohydride Anion BH4−: A 11B NMR Study Showing the Formation of Short-Living Reaction Intermediates including BH3OH−
Authors: Petit Eddy , Salles Fabrice , Alligier Damien , Demirci Umit B.
Published: March 2022

In hydrolysis and electro-oxidation of the borohydride anion BH4−, key reactions in the field of energy, one critical short-living intermediate is BH3OH−. When water was used as both solvent and reactant, only BH3OH− is detected by 11B NMR. By moving away from such conditions and using DMF as solvent and water as reactant in excess, four 11B NMR quartets were observed. These signals were due to BH3-based intermediates as suggested by theoretical calculations; they were DMF·BH3, BH3OH−, and B2H7− (i.e., [H3B−H−BH3]− or [H4B−BH3]−). Our results shed light on the importance of BH3 stemming from BH4− and on its capacity as Lewis acid to interact with Lewis bases such as DMF, OH−, and BH4−. These findings are important for a better understanding at the molecular level of hydrolysis of BH4− and production of impurities in boranes synthesis.
Metabonomics Analysis of Stem Extracts from Dalbergia sissoo
Authors: Li Mengxue , Liu Mengying , Wang Bingyi , Shi Lei
Published: March 2022

Dalbergia sissoo is a woody plant with economic and medicinal value. As the pharmacological qualities and properties of the wood from this plant primarily depend on its extractives, in this study, the metabolomic analysis of extractives from its stems was carried out using UPLC-MS/MS. A total of 735 metabolites were detected from two groups of samples, heartwood and sapwood, with the largest number of terpenoids in type and the largest number of flavonoids in quantity. The PCA and cluster analysis showed significant differences in the metabolite composition between the two groups. The differential metabolites were mainly organic oxygen compounds, flavonoids, and isoflavones. Among the 105 differential metabolites, 26 metabolites were significantly higher in relative content in sapwood than in heartwood, while the other 79 metabolites were significantly higher in relative content in heartwood than in sapwood. KEGG metabolic pathway enrichment analysis showed that these differential metabolites were mainly enriched in three metabolic pathways: Flavonoid biosynthesis, isoflavonoid biosynthesis, and flavonoid and flavonol biosynthesis. This study provides a reference for metabolomics studies in Dalbergia and other woody plants.
Positive Effect of α-Asaronol on the Incidence of Post-Stroke Epilepsy for Rat with Cerebral Ischemia-Reperfusion Injury
Authors: Jiang Lan , Hu Xiangnan
Published: March 2022

In the present study, we confirmed that α-asaronol, which is a product of the active metabolites of alpha Asarone, did not affect n-butylphthalide efficacy when n-butylphthalide and α-asaronol were co-administered to rats with cerebral ischemia-reperfusion injury. Our research revealed that the co-administration of α-asaronol and n-butylphthalide could further improve neurological function, reduce brain infarct volume, increase the number of Nissl bodies, and decrease the ratios of apoptotic cells and the expression of the caspase-3 protein for cerebral ischemia-reperfusion injury model compared to n-butylphthalide alone. Additionally, α-asaronol could significantly decrease the incidence of post-stroke epilepsy versus n-butylphthalide. This study provides valuable data for the follow-up prodrug research of α-asaronol and n-butylphthalide.
In Silico Structure-Based Approach for Group Efficiency Estimation in Fragment-Based Drug Design Using Evaluation of Fragment Contributions
Authors: Shulga Dmitry A. , Ivanov Nikita N. , Palyulin Vladimir A.
Published: March 2022

The notion of a contribution of a specific group in an organic molecule’s property and/or activity is both common in our thinking and is still not strictly correct due to the inherent non-additivity of free energy with respect to molecular fragments composing a molecule. The fragment- based drug discovery (FBDD) approach has proven to be fruitful in addressing the above notions. The main difficulty of the FBDD, however, is in its reliance on the low throughput and expensive experimental means of determining the fragment-sized molecules binding. In this article we propose a way to enhance the throughput and availability of the FBDD methods by judiciously using an in silico means of assessing the contribution to ligand-receptor binding energy of fragments of a molecule under question using a previously developed in silico Reverse Fragment Based Drug Discovery (R-FBDD) approach. It has been shown that the proposed structure-based drug discovery (SBDD) type of approach fills in the vacant niche among the existing in silico approaches, which mainly stem from the ligand-based drug discovery (LBDD) counterparts. In order to illustrate the applicability of the approach, our work retrospectively repeats the findings of the use case of an FBDD hit-to-lead project devoted to the experimentally based determination of additive group efficiency (GE)—an analog of ligand efficiency (LE) for a group in the molecule—using the Free-Wilson (FW) decomposition. It is shown that in using our in silico approach to evaluate fragment contributions of a ligand and to estimate GE one can arrive at similar decisions as those made using the experimentally determined activity-based FW decomposition. It is also shown that the approach is rather robust to the choice of the scoring function, provided the latter demonstrates a decent scoring power. We argue that the proposed approach of in silico assessment of GE has a wider applicability domain and expect that it will be widely applicable to enhance the net throughput of drug discovery based on the FBDD paradigm.
General Method of Synthesis of 5-(Het)arylamino-1,2,3-triazoles via Buchwald–Hartwig Reaction of 5-Amino- or 5-Halo-1,2,3-triazoles
Authors: Gribanov Pavel S. , Philippova Anna N. , Topchiy Maxim A. , Minaeva Lidiya I. , Asachenko Andrey F. , Osipov Sergey N.
Published: March 2022

An efficient access to the novel 5-(het)arylamino-1,2,3-triazole derivatives has been developed. The method is based on Buchwald–Hartwig cross-coupling reaction of 5-Amino or 5-Halo-1,2,3-triazoles with (het)aryl halides and amines, respectively. As result, it was found that palladium complex [(THP-Dipp)Pd(cinn)Cl] bearing expanded-ring N-heterocyclic carbene ligand is the most active catalyst for the process to afford the target molecules in high yields.
Dry Dosage Forms of Add-Value Bioactive Phenolic Compounds by Supercritical CO2-Assisted Spray-Drying
Authors: Costa Clarinda , Anselmo Hugo , Ferro Rita , Matos Ana Sofia , Casimiro Teresa , Aguiar-Ricardo Ana
Published: March 2022

Every year, grapevine pruning produces huge amounts of residue, 90% of which are from vine shoots. These are a rich source of natural antioxidants, mostly phenolic compounds, which, when properly extracted, can give rise to added-value products. However, their lack of solubility in aqueous media and high susceptibility to thermal and oxidative degradation highly limit their bioavailability. Encapsulation in suitable carriers may have a positive impact on their bioavailability and bioactivity. Previous data on vine-shoot extraction have identified gallic acid (GA) and resveratrol (RSV) as the main phenolic compounds. In this work, model dry powder formulations (DPFs) of GA and RSV using hydroxypropyl cellulose (HPC) as carriers were developed using Supercritical CO2-Assisted Spray Drying (SASD). A 32 full factorial Design of Experiments investigated the solid and ethanol contents to ascertain process yield, particle size, span, and encapsulation efficiency. Amorphous powder yields above 60%, and encapsulation efficiencies up to 100% were achieved, representing excellent performances. SASD has proven to be an efficient encapsulation technique for these phenolic compounds, preserving their antioxidation potential after three months in storage with average EC50 values of 30.6 µg/mL for GA–DPFs and 149.4 µg/mL for RSV–DPF as assessed by the scavenging capacity of the DPPH radical.
Fabrication of TiO2/NiO p-n Nanocomposite for Enhancement Dye Photodegradation under Solar Radiation
Authors: Zayed Mohamed , Samy Salsbeel , Shaban Mohamed , Altowyan Abeer S. , Hamdy Hany , Ahmed Ashour M.
Published: March 2022

A p-n nanocomposite based on TiO2 nanotubes (NTs) and NiO nanoparticles (NPs) was designed and optimized in this study to improve the photocatalytic performance of methylene blue (MB). The hydrothermal technique has been used to produce TiO2/NiO nanocomposites with different NiO NPs weight ratios; 1TiO2:1NiO, 1TiO2:2NiO, and 1TiO2:3NiO. The crystal phase, chemical composition, optical properties, and morphology of TiO2/NiO were explored by various techniques. TiO2 NTs have a monoclinic structure, while NiO NPs have a cubic structure, according to the structural study. The bandgap of TiO2 NTs was reduced from 3.54 eV to 2.69 eV after controlling the NiO NPs weight ratio. The TiO2/2NiO nanocomposite showed the best photodegradation efficiency. Within 45 min of solar light irradiation, the efficiency of MB dye degradation using TiO2/2NiO hits 99.5% versus 73% using pure TiO2 NTs. Furthermore, the catalytic photodegradation efficiency did not deteriorate significantly even after five reusability cycles, intimating the high stability of the TiO2/2NiO nanocomposite. This suggests that the loading of NiO NPs into TiO2 NTs lowers the recombination of photo-produced electron/hole pairs and enlarged solar spectral response range, which results in improved photocatalytic activity. The mechanism of charge transfer in the TiO2/NiO and kinetic models were discussed for the photodegradation of MB.
Pulse-Atomic Force Lithography: A Powerful Nanofabrication Technique to Fabricate Constant and Varying-Depth Nanostructures
Authors: Pellegrino Paolo , Bramanti Alessandro Paolo , Farella Isabella , Cascione Mariafrancesca , De Matteis Valeria , Della Torre Antonio , Quaranta Fabio , Rinaldi Rosaria
Published: March 2022

The widespread use of nanotechnology in different application fields, resulting in the integration of nanostructures in a plethora of devices, has addressed the research toward novel and easy-to-setup nanofabrication techniques to realize nanostructures with high spatial resolution and reproducibility. Owing to countless applications in molecular electronics, data storage, nanoelectromechanical, and systems for the Internet of Things, in recent decades, the scientific community has focused on developing methods suitable for nanopattern polymers. To this purpose, Atomic Force Microscopy-based nanolithographic techniques are effective methods that are relatively less complex and inexpensive than equally resolute and accurate techniques, such as Electron Beam lithography and Focused Ion Beam lithography. In this work, we propose an evolution of nanoindentation, named Pulse-Atomic Force Microscopy, to obtain continuous structures with a controlled depth profile, either constant or variable, on a polymer layer. Due to the modulation of the characteristics of voltage pulses fed to the AFM piezo-scanner and distance between nanoindentations, it was possible to indent sample surface with high spatial control and fabricate highly resolved 2.5D nanogrooves. That is the real strength of the proposed technique, as no other technique can achieve similar results in tailor-made graded nanogrooves without the need for additional manufacturing steps.
Optical Properties of Mn-Doped CuGa(In)S-ZnS Nanocrystals (NCs): Effects of Host NC and Mn Concentration
Authors: Lee Bryan , Hegseth Tristan , Zhu Xiaoshan
Published: March 2022

Time-gated fluorescence measurement (TGFM) using long-life fluorescence probes is a highly sensitive fluorescence-measurement technology due to the inherently high signal-to-background ratio. Although many probes for TGFM such as luminescent-metal-complex probes and lanthanide-doped nanoparticles are in development, they generally need sophisticated/expensive instruments for biosensing/imaging applications. Probes possessing high brightness, low-energy (visible light) excitation, and long lifetimes up to milliseconds of luminescence, are highly desired in order to simplify the optical and electronic design of time-gated instruments (e.g., adopting non-UV-grade optics or low-speed electronics), lower the instrument complexity and cost, and facilitate broader applications of TGFM. In this work, we developed Mn-doped CuGa(In)S-ZnS nanocrystals (NCs) using simple and standard synthetic steps to achieve all the desired optical features in order to investigate how the optical properties (fluorescence/absorption spectra, brightness, and lifetimes) of the Mn-doped NCs are affected by different host NCs and Mn concentrations in host NCs. With optimal synthetic conditions, a library of Mn-doped NCs was achieved that possessed high brightness (up to 47% quantum yield), low-energy excitation (by 405 nm visible light), and long lifetimes (up to 3.67 ms). Additionally, the time-domain fluorescence characteristics of optimal Mn-doped NCs were measured under pulsed 405 nm laser excitation and bandpass-filter-based emission collection. The measurement results indicate the feasibility of these optimal Mn-doped NCs in TGFM-based biosensing/imaging.
Role of Surface Energy of Nanoparticle Stabilizers in the Synthesis of Microspheres via Pickering Emulsion Polymerization
Authors: Honciuc Andrei , Negru Oana-Iuliana
Published: March 2022

Polymer microspheres are important for a variety of applications, such as ion exchange chromatography, catalyst supports, absorbents, etc. Synthesis of large microspheres can be challenging, because they cannot be obtained easily via classic emulsion polymerization, but rather by more complex methods. Here, we present a facile method for obtaining polymer microspheres, beyond 50 μm, via Pickering emulsion polymerization. The method consists in creating oil-in-water (o/w) Pickering emulsion/suspension from vinyl bearing monomers, immiscible with water, whereas silica nanoparticles (NPs), bearing glycidyl functionalities, have a stabilizing role by adsorbing at the monomer/water interface of emulsion droplets. The emulsion is polymerized under UV light, and polymer microspheres decorated with NPs are obtained. We discovered that the contact angle of the NPs with the polymer microsphere is the key parameter for tuning the size and the quality of the obtained microspheres. The contact angle depends on the NPs’ interfacial energy and its polar and dispersive contributions, which we determine with a newly developed NanoTraPPED method. By varying the NPs’ surface functionality, we demonstrate that when their interfacial energy with water decreases, their energy of adhesion to water increases, causing the curvature of the polymer/water interface to decrease, resulting in increasingly larger polymer microspheres.
Controllable Introduction of Surface Defects on CH3NH3PbI3 Perovskite
Authors: Wan Sushu , Zhu Yajie , Hong Daocheng , Tian Yuxi
Published: March 2022

One of the unique characteristics of semiconductors is the strong dependence of their properties on crystal defects and doping. However, due to the species diversity and low density, it is very difficult to control the type and concentration of the defects. In perovskite materials, crystal defects are randomly formed during the fast crystallization process, causing large heterogeneity of the samples. Here, in this work, we report a controllable method to introduce surface defects on CH3NH3PbI3 perovskite materials via the interaction with 1,4-benzoquinone (BQ) molecules on the gas and solid interface. After the adsorption of BQ molecules on the perovskite surface, surface defects can be generated by photoinduced chemical reactions. The concentration of the defects can thus be controlled by precisely regulating the laser irradiation time. The concentration of the defects can be characterized by a gradually decreased PL intensity and lifetime and was found to influence the atmospheric response and the subsequent acetone-induced degradation of the materials. These results demonstrate that crystal defects in perovskite materials can be controllably introduced, which provides a possible way to fully understand the correlation between the nature and chemical structure of these defects.
Polysaccharides and Metal Nanoparticles for Functional Textiles: A Review
Authors: Fernandes Marta , Padrão Jorge , Ribeiro Ana I. , Fernandes Rui D. V. , Melro Liliana , Nicolau Talita , Mehravani Behnaz , Alves Cátia , Rodrigues Rui , Zille Andrea
Published: March 2022

Nanotechnology is a powerful tool for engineering functional materials that has the potential to transform textiles into high-performance, value-added products. In recent years, there has been considerable interest in the development of functional textiles using metal nanoparticles (MNPs). The incorporation of MNPs in textiles allows for the obtention of multifunctional properties, such as ultraviolet (UV) protection, self-cleaning, and electrical conductivity, as well as antimicrobial, antistatic, antiwrinkle, and flame retardant properties, without compromising the inherent characteristics of the textile. Environmental sustainability is also one of the main motivations in development and innovation in the textile industry. Thus, the synthesis of MNPs using ecofriendly sources, such as polysaccharides, is of high importance. The main functions of polysaccharides in these processes are the reduction and stabilization of MNPs, as well as the adhesion of MNPs onto fabrics. This review covers the major research attempts to obtain textiles with different functional properties using polysaccharides and MNPs. The main polysaccharides reported include chitosan, alginate, starch, cyclodextrins, and cellulose, with silver, zinc, copper, and titanium being the most explored MNPs. The potential applications of these functionalized textiles are also reported, and they include healthcare (wound dressing, drug release), protection (antimicrobial activity, UV protection, flame retardant), and environmental remediation (catalysts).
Selective Mid-IR Metamaterial-Based Gas Sensor System: Proof of Concept and Performances Tests
Authors: Mihai Laura , Mihalcea Razvan , Tomescu Roxana , Paun Costel , Cristea Dana
Published: March 2022

In this paper, we propose a highly selective and efficient gas detection system based on a narrow-band IR metasurface emitter integrated with a resistive heater. In order to develop the sensor for the detection of specific gases, both the microheater and metasurface structures have been optimized in terms of geometry and materials. Devices with different metamaterial structures and geometries for the heater have been tested. Our prototype showed that the modification of the spectral response of metasurface-based structures is easily achieved by adapting the geometrical parameters of the plasmonic micro-/nanostructures in the metasurface. The advantage of this system is the on-chip integration of a thermal source with broad IR radiation with the metasurface structure, obtaining a compact selective radiation source. From the experimental data, narrow emission peaks (FWHM as low as 0.15 μm), corresponding to the CO2, CH4, and CO absorption bands, with a radiant power of a few mW were obtained. It has been shown that, by changing the bias voltage, a shift of a few tens of nm around the central emission wavelength can be obtained, allowing fine optimization for gas detection applications.
Thermophysical Properties of Nanofluid in Two-Phase Fluid Flow through a Porous Rectangular Medium for Enhanced Oil Recovery
Authors: Al-Yaari Abdullah , Ching Dennis Ling Chuan , Sakidin Hamzah , Muthuvalu Mohana Sundaram , Zafar Mudasar , Alyousifi Yousif , Saeed Anwar Ameen Hezam , Bilad Muhammad Roil
Published: March 2022

It is necessary to sustain energy from an external reservoir or employ advanced technologies to enhance oil recovery. A greater volume of oil may be recovered by employing nanofluid flooding. In this study, we investigated oil extraction in a two-phase incompressible fluid in a two-dimensional rectangular porous homogenous area filled with oil and having no capillary pressure. The governing equations that were derived from Darcy’s law and the mass conservation law were solved using the finite element method. Compared to earlier research, a more efficient numerical model is proposed here. The proposed model allows for the cost-effective study of heating-based inlet fluid in enhanced oil recovery (EOR) and uses the empirical correlations of the nanofluid thermophysical properties on the relative permeability equations of the nanofluid and oil, so it is more accurate than other models to determine the higher recovery factor of one nanoparticle compared to other nanoparticles. Next, the effect of nanoparticle volume fraction on flooding was evaluated. EOR via nanofluid flooding processes and the effect of the intake temperatures (300 and 350 K) were also simulated by comparing three nanoparticles: SiO2, Al2O3, and CuO. The results show that adding nanoparticles (<5 v%) to a base fluid enhanced the oil recovery by more than 20%. Increasing the inlet temperature enhanced the oil recovery due to changes in viscosity and density of oil. Increasing the relative permeability of nanofluid while simultaneously reducing the relative permeability of oil due to the presence of nanoparticles was the primary reason for EOR.
Widely Tuneable Composition and Crystallinity of Graded Na1+xTaO3±δ Thin Films Fabricated by Chemical Beam Vapor Deposition
Authors: Garlisi Corrado , Lunca Popa Petru , Menguelti Kevin , Rogé Vincent , Michel Marc , Vergne Christèle , Guillot Jérôme , Wagner Estelle , Maudez William , Benvenuti Giacomo , Pistillo Bianca Rita , Barborini Emanuele
Published: March 2022

Combinatorial approach has been widely recognized as a powerful strategy to develop new-higher performance materials and shed the light on the stoichiometry-dependent properties of known systems. Herein, we take advantage of the unique features of chemical beam vapor deposition to fabricate compositionally graded Na1+xTaO3±δ thin films with −0.6 < x < 0.5. Such a varied composition was enabled by the ability of the employed technique to deliver and combine an extensive range of precursors flows over the same deposition area. The film growth occurred in a complex process, where precursor absolute flows, flow ratios, and substrate temperature played a role. The deviation of the measured Na/Ta ratios from those predicted by flow simulations suggests that a chemical-reaction limited regime underlies the growth mechanism and highlights the importance of the Ta precursor in assisting the decomposition of the Na one. The crystallinity was observed to be strongly dependent on its stoichiometry. High under-stoichiometries (e.g., Na0.5TaO3−δ) compared to NaTaO3 were detrimental for the formation of a perovskite framework, owing to the excessive amount of sodium vacancies and oxygen vacancies. Conversely, a well-crystallized orthorhombic perovskite structure peculiar of NaTaO3 was observed from mildly under-stoichiometric (e.g., Na0.9TaO3−δ) to highly over-stoichiometric (e.g., Na1.5TaO3+δ) compositions.
WC-High Entropy Alloy Reinforced Long Life Self-Grinding Silage Knife Prepared by Laser Cladding
Authors: Xu Lingfeng , Li Mingxiang , Song Zhanhua , Li Fade , Guo Jing , Gao Ming
Published: March 2022

The working environment of agricultural knives is bad, which makes the knives wear out easily. A wear resistant layer of AlCoCrFeNi high entropy alloy (HEA) reinforced by tungsten carbide (WC) was prepared by laser cladding on one side of the cutting edge of a 65 Mn silage knife. Both the effects of WC addition on the microstructure and mechanical properties of AlCoCrFeNi (WC)x (x = 0, 0.1, 0.2 and 0.3 in mass percentage) alloys were investigated. All experimental alloys displayed a crystalline structure of simple body centered cubic (BCC). The hardness of the cladding layer increases with the increase of WC content, and the hardness value enhances from 740 HV0.2 to 1060 HV0.2. A self-grinding edge was formed during working for the cladded knives. The cutting quality can be improved and the service life of agricultural knives can be increased meanwhile. The weight loss rate of untreated knives was about 2.64 times that of the cladded knives after a 76 h field experiment.
Carbon Nanotubes Interconnected NiCo Layered Double Hydroxide Rhombic Dodecahedral Nanocages for Efficient Oxygen Evolution Reaction
Authors: Li Meng , Huang Yujie , Lin Jiaqi , Li Meize , Jiang Mengqi , Ding Linfei , Sun Dongmei , Huang Kai , Tang Yawen
Published: March 2022

Proper control of a 3d transition metal-based catalyst with advanced structures toward oxygen evolution reaction (OER) with a more feasible synthesis strategy is of great significance for sustainable energy-related devices. Herein, carbon nanotube interconnected NiCo layered double hydroxide rhombic dodecahedral nanocages (NiCo-LDH RDC@CNTs) were developed here with the assistance of a feasible zeolitic imidazolate framework (ZIF) self-sacrificing template strategy as a highly efficient OER electrocatalyst. Profited by the well-fined rhombic dodecahedral nanocage architecture, CNTs’ interconnected characteristic and structural feature of the vertically aligned nanosheets, the as-synthesized NiCo-LDH RDC@CNTs integrated large exposed active surface areas, enhanced electron transfer capacity and multidimensional mass diffusion channels, and thereby collaboratively afforded the remarkable electrocatalytic performance of the OER. Specifically, the designed NiCo-LDH RDC@CNTs exhibited a distinguished OER activity, which only required a low overpotential of 255 mV to reach a current density of 10 mA cm−2 for the OER. For the stability, no obvious current attenuation was detected, even after continuous operation for more than 27 h. We certainly believe that the current extraordinary OER activity combined with the robust stability of NiCo-LDH RDC@CNTs enables it to be a great candidate electrocatalyst for economical and sustainable energy-related devices.
Room-Temperature, Ionic-Liquid-Enhanced, Beta-Cyclodextrin-Based, Molecularly Imprinted Polymers for the Selective Extraction of Abamectin
Authors: Farooq Saqib , Chen Bochang , Ahmad Shakeel , Muhammad Ihsan , Hussain Quaid , Wu Haiyan
Published: March 2022

To ensure environmental protection and food quality and safety, the trace level detection of pesticide residues with molecularly imprinted polymers using a more economic, reliable, and greener approach is always demanded. Herein, novel, enhanced, imprinted polymers based on beta-cyclodextrin, using room-temperature, ionic liquid as a solvent for abamectin were developed with a simple polymerization process. The successful synthesis of the polymers was verified, with morphological and structural characterization performed via scanning electron microscope analysis, nitrogen adsorption experiments, and thermogravimetric analysis. The imprinted polymers showed good adsorption ability, which was confirmed with a pseudo-second-order kinetic model and a Langmuir isotherm model, as they exhibit a theoretical adsorption of 15.08 mg g−1 for abamectin. The polymers showed high selectivity for abamectin and significant reusability without significant performance loss. The MIPs were used to analyze abamectin in spiked apple, banana, orange, and grape samples, and as a result, a good recovery of 81.67−101.47%, with 1.26−4.36% relative standard deviation, and limits of detection and quantitation of 0.02 µg g−1 and 0.05 µg g−1, respectively, was achieved within a linear range of 0.03−1.50 µg g−1. Thus, room-temperature, ionic-liquid-enhanced, beta-cyclodextrin-based, molecularly imprinted polymers for the selective detection of abamectin proved to be a convenient and practical platform.
Cluster-Based Transmission Diversity Optimization in Ultra Reliable Low Latency Communication
Authors: Shanto Md. Amirul Hasan , Binodon  , Karmaker Amit , Reza Md. Mahfuz , Hossain Md. Abir
Published: March 2022

Intra-vehicular communication is an emerging technology explored spontaneously due to higher wireless sensor-based application demands. To meet the upcoming market demands, the current intra-vehicular communication transmission reliability and latency should be improved significantly to fit with the existing 5G and upcoming 6G communication domains. Ultra-Reliable Low-Latency Communication (URLLC) can be widely used to enhance the quality of communication and services of 5G and beyond. The 5G URLLC service is highly dependable for transmission reliability and minimizing data transmission latency. In this paper, a multiple-access scheme named Cluster-based Orthogonal Frequency Subcarrier-based Multiple Access (C-OFSMA) is proposed with 5G URLLC’s high requirement adaptation for intra-vehicular data transmission. The URLLC demanded high reliability of approximately 99.999% of the data transmission within the extremely short latency of less than 1 ms. C-OFSMA enhanced the transmission diversity, which secured more successful data transmission to fulfill these high requirements and adapt to such a network environment. In C-OFSMA, the available sensors transmit data over specific frequency channels where frequency selection is random and special sensors (audio and video) transmit data over dedicated frequency channels. The minimum number of subcarrier channels was evaluated for different arrival rates and different packet duplication conditions in order to achieve 99.999% reliability within an air-interface latency of 0.2 ms. For the fixed frequency channel condition, C-OFSMA and OFSMA were compared in terms of reliability response and other packet duplication. Moreover, the optimal number of clusters was also evaluated in the aspects of the reliability response for the C-OFSMA system.
Adherence to Clinical Practice Guideline Recommendations in Women with Gestational Diabetes and Associations with Maternal and Infant Health—A Cohort Study
Authors: Mustafa Sara T. , Harding Jane E. , Wall Clare R. , Crowther Caroline A.
Published: March 2022

Gestational diabetes mellitus (GDM) is managed by dietary advice, but limited evidence exists about the impact of adherence on health. We assessed whether adherence to the New Zealand Ministry of Health dietary recommendations is associated with maternal and infant health in women with GDM. Data from 313 women with GDM were used. Adherence to food-related recommendations was scored from 0 (no adherence) to 10 (adhered to all recommendations) and analysed in tertile groups (high, moderate, low adherence). Adherence to visiting a dietitian and appropriate weight gain were assessed as yes or no. Chi-square, ANOVA, and odds ratios were used to compare groups. High dietary adherence compared to low adherence was associated with reduced oral hypoglycaemic and insulin use (OR = 0.55, CI = 0.30–1.00). Visiting a dietitian compared to not was associated with increased oral hypoglycaemic and insulin use (OR = 2.96, CI = 1.12–7.80), decreased odds of a large-for-gestational-age infant (OR = 0.32, CI = 0.14–0.73) and neonatal hyperbilirubinaemia (OR = 0.27, CI = 0.08–0.95). Greater than recommended compared with recommended weight gain was associated with increased oral hypoglycaemic and insulin use (OR = 2.51, CI = 1.26–5.01), while lower than recommended weight gain was associated with decreased postpartum haemorrhage (OR = 0.45, CI = 0.23–0.91) and increased breastfeeding (OR = 1.96, CI = 1.04–3.70). Adherence to dietary recommendations for women with GDM likely improves health outcomes.
Nutrition in Spondyloarthritis and Related Immune-Mediated Disorders
Authors: Popa Stefan Lucian , Dumitrascu Dinu Iuliu , Brata Vlad Dumitru , Duse Traian Adrian , Florea Maria Delia , Ismaiel Abdulrahman , Muntean Laura Mirela , Grad Simona
Published: March 2022

Recent research on the pathogenesis of spondyloarthritis and related immune-mediated diseases associated with human leukocyte antigen class I molecule B27 (HLA-B27) has led to significant progress in terms of management and prognosis, with multiple treatments being constantly evaluated and implemented. Correlations between the genetic background of spondyloarthritis and inflammatory bowel diseases and the inflammatory processes involving gut microbiota have been established. This knowledge has allowed progress in pharmacological therapy. The role of diet in the pathogenesis and treatment of diseases pertaining to the HLA-B27 spectrum is of great significance, considering possible future applications in individualized medicine. Diet impacts the composition of gut microbiota, representing a substrate for the synthesis of metabolites affecting the mucosal immune system. Certain pro-inflammatory mediators, such as emulsifiers and microparticles, induce a more profound cytokine response, promoting inflammation. Numerous diets, including the low-starch diet, the Mediterranean diet, diets with low contents of fermentable oligosaccharides, disaccharides, monosaccharides and polyols (low-FODMAP diets), gluten-free diets and fasting, have been analysed and correlated with patients’ symptomatology and dietary adherence. The aim of this review is to provide an extensive perspective on the diets available to patients with spondyloarthritis and related immune-mediated disorders.
Analysis of the Ability of Capsaicin to Modulate the Human Gut Microbiota In Vitro
Authors: Mahalak Karley K. , Bobokalonov Jamshed , Firrman Jenni , Williams Russell , Evans Bradley , Fanelli Brian , Soares Jason W. , Kobori Masuko , Liu LinShu
Published: March 2022

Previous studies on capsaicin, the bioactive compound in chili peppers, have shown that it may have a beneficial effect in vivo when part of a regular diet. These positive health benefits, including an anti-inflammatory potential and protective effects against obesity, are often attributed to the gut microbial community response to capsaicin. However, there is no consensus on the mechanism behind the protective effect of capsaicin. In this study, we used an in vitro model of the human gut microbiota to determine how regular consumption of capsaicin impacts the gut microbiota. Using a combination of NextGen sequencing and metabolomics, we found that regular capsaicin treatment changed the structure of the gut microbial community by increasing diversity and certain SCFA abundances, particularly butanoic acid. Through this study, we determined that the addition of capsaicin to the in vitro cultures of the human gut microbiome resulted in increased diversity of the microbial community and an increase in butanoic acid. These changes may be responsible for the health benefits associated with CAP consumption.
Rapid Nontranscriptional Effects of Calcifediol and Calcitriol
Authors: Donati Simone , Palmini Gaia , Aurilia Cinzia , Falsetti Irene , Miglietta Francesca , Iantomasi Teresa , Brandi Maria Luisa
Published: March 2022

Classically, a secosteroid hormone, vitamin D, has been implicated in calcium and phosphate homeostasis and has been associated with the pathogenesis of rickets and osteomalacia in patients with severe nutritional vitamin D deficiency. The spectrum of known vitamin D-mediated effects has been expanded in recent years. However, the mechanisms of how exactly this hormone elicits its biological function are still not fully understood. The interaction of this metabolite with the vitamin D receptor (VDR) and, subsequently, with the vitamin D-responsive element in the region of specific target genes leading to the transcription of genes whose protein products are involved in the traditional function of calcitriol (known as genomic actions). Moreover, in addition to these transcription-dependent mechanisms, it has been recognized that the biologically active form of vitamin D3, as well as its immediate precursor metabolite, calcifediol, initiate rapid, non-genomic actions through the membrane receptors that are bound as described for other steroid hormones. So far, among the best candidates responsible for mediating rapid membrane response to vitamin D metabolites are membrane-associated VDR (VDRm) and protein disulfide isomerase family A member 3 (Pdia3). The purpose of this paper is to provide an overview of the rapid, non-genomic effects of calcifediol and calcitriol, whose elucidation could improve the understanding of the vitamin D3 endocrine system. This will contribute to a better recognition of the physiological acute functions of vitamin D3, and it could lead to the identification of novel therapeutic targets able to modulate these actions.
Taurine Supplementation as a Neuroprotective Strategy upon Brain Dysfunction in Metabolic Syndrome and Diabetes
Authors: Rafiee Zeinab , García-Serrano Alba M. , Duarte João M. N.
Published: March 2022

Obesity, type 2 diabetes, and their associated comorbidities impact brain metabolism and function and constitute risk factors for cognitive impairment. Alterations to taurine homeostasis can impact a number of biological processes, such as osmolarity control, calcium homeostasis, and inhibitory neurotransmission, and have been reported in both metabolic and neurodegenerative disorders. Models of neurodegenerative disorders show reduced brain taurine concentrations. On the other hand, models of insulin-dependent diabetes, insulin resistance, and diet-induced obesity display taurine accumulation in the hippocampus. Given the possible cytoprotective actions of taurine, such cerebral accumulation of taurine might constitute a compensatory mechanism that attempts to prevent neurodegeneration. The present article provides an overview of brain taurine homeostasis and reviews the mechanisms by which taurine can afford neuroprotection in individuals with obesity and diabetes. We conclude that further research is needed for understanding taurine homeostasis in metabolic disorders with an impact on brain function.
Nutrition in Advanced Thyroid Cancer Patients
Authors: Agate Laura , Minaldi Elisa , Basolo Alessio , Angeli Valentina , Jaccheri Roberta , Santini Ferruccio , Elisei Rossella
Published: March 2022

In the last decade, multikinase inhibitors (MKIs) have changed the paradigm of treatment of advanced and progressive thyroid cancer. Compared with the traditional treatment with chemotherapy and radiotherapy, these new drugs have shown a good efficacy in controlling the neoplastic disease, and also a different toxicity profile compared to traditional chemotherapy, milder but still present and involving mainly the nutritional profile. Weight loss, nausea, anorexia, stomatitis, diarrhea may be associated with malnutrition and cancer-related cachexia. The latter is characteristic of the advanced cancer stage and may be present before starting MKIs, or may develop afterwards. Adverse events with nutritional impact may cause a significant impairment of quality of life, often requiring dose reduction and sometimes drug discontinuation, but with a lower efficacy on the neoplastic disease. The aim of this paper was to discuss the role of nutritional therapy in advanced thyroid cancer and the importance of prevention, early recognition and careful management of malnutrition and cachexia during systemic therapy with MKIs.
The Association between Diet Quality and Health Status in Mobile Food Pantry Users in Northeastern Connecticut
Authors: Marmash Dalia , Ha Kyungho , Sakaki Junichi R. , Gorski Isabella , Rule Brazil , Puglisi Michael , Chun Ock K.
Published: March 2022

Low-income Americans tend to have poor diet quality and disease prevalence overall. Mobile food pantries aim to improve these outcomes, and have rarely been studied. This cross-sectional study aimed to evaluate the association between diet quality and health status in mobile food pantry users. Data were collected from two mobile food pantry sites in Northeastern Connecticut (n = 83). Sociodemographic food security and diet quality data were collected. Overall, diet quality was low among all participants with intakes of fruits, vegetables, and whole grains of concern. Participant adherence to the 2020–2025 US Dietary Guidelines were low, with no participants meeting recommendations for whole grains. Obesity, diabetes, and hypertension prevalence in this population exceeded national averages. After adjusting for covariates, hypertension was associated with higher dairy and added sugar intake, as well as a greater intake of added sugar from sugar-sweetened beverages (p < 0.05). Although results were not statistically significant, participants with obesity, diabetes, and hypertension showed a trend of having lower adherence to the guidelines than those without these chronic diseases. Questions assessing participant interest in changing their diets were also posed, indicating overall high interest in learning about current diet quality and weight improvement.
Self-Perceived Competence of Ambulance Nurses in the Care of Patients with Mental Illness: A Questionnaire Survey
Authors: Önnheim Sandra , Johansson Anders , Ivarsson Bodil , Hagström Caroline
Published: March 2022

Ambulance nurses in prehospital emergency care must assess, treat, and triage patients with mental health issues. This study aimed to investigate the self-perceived competence of ambulance nurses in prehospital emergency care of patients with mental illness. A cross-sectional questionnaire survey was done, a question-index value (Q-IV; range: 0–1.0) was defined as a summary of the proportion of positive responses (%). Correlations of self-perceived competence with education and professional experience were also examined. Overall self-perceived competence was good (mean Q-IV, 0.80). For six of the nine questions, women rated their abilities slightly lower than men. Women rated themselves as fairly good in providing “information about types of effective help available” (Q-IV, 0.55) and in “suggesting tactics for helping a person with mental illness feel better” (Q-IV, 0.56). Men rated their competence as fairly good in “directing patients to appropriate sources of help” (Q-IV, 0.58). Self-perceived competence did not correlate with education level or professional experience. In conclusion, these results indicate that in encounters with patients who have mental illness, ambulance nurses perceive their overall competencies as good, with some sex-based differences in self-perception for specific knowledge areas. Education level and professional experience did not correlate with self-perceived competence.
Person-Centered Practice in the Portuguese Healthcare Services: A Scoping Review Protocol
Authors: Ventura Filipa , Costeira Cristina R. B. , Silva Rosa , Cardoso Daniela , Oliveira Cláudia
Published: March 2022

Recognizing the importance of the international advancements on person-centered practice (PCP) with positive implementation outcomes at the varied levels of healthcare systems, this scoping review will examine the PCP in Portuguese healthcare services. The Joanna Briggs Institute (JBI) guidance for scoping reviews will be followed. The Population (P) Concept (C) Context (C) mnemonic will scaffold research questions, the inclusion and exclusion criteria, and the searching strategy. Literature reporting on person-centeredness domains at the macro-, meso-, and micro levels applied to Portuguese healthcare services in Portuguese and English will be considered for inclusion. Accordingly, MEDLINE, CINAHL, SCOPUS, LILACS, SCIELO, Open Access Scientific Repository of Portugal (RCAAP), and Open gray will be searched. The literature will be screened for eligibility by two independent reviewers, first by title and abstract and subsequently by full text. A data extraction matrix designed to answer the research questions will be used for the included literature. The charted data will be thematically analyzed and presented graphically, with a narrative description of the literature characteristics. The results are expected to inform healthcare stakeholders at varying levels about the PCP domains where further improvements might be required in order to raise the quality of care to the international gold standards.
The Use of Pythium oligandrum in the Biological Control of Roundworm Infection in Dogs and Cats
Authors: Luca Iasmina , Ilie Marius Stelian , Florea Tiana , Olariu-Jurca Adrian , Stancu Adrian , Dărăbuş Gheorghe
Published: March 2022

Pythium oligandrum is an oomycete used in veterinary medicine to treat dermatophytosis in animals. The ovicidal potential against various types of parasite eggs has not been investigated. Ascarids are very common in young animals and the resistance of eggs in the external environment is very high. A commercial product containing P. oligandrum was used in the present study. Its ovicidal action against Toxocara spp. eggs was investigated. Thus, two categories of media (soil and sandstone) were used, on which the ascarid eggs were dispersed. The commercial product was prepared as a solution and was applied according to the manufacturer. The treatment scheme indicated in case of animals with dermatophytosis was used. Thus, the external natural conditions were recreated in the laboratory, in order to establish whether there is any applicability for this oomycete in the biological control of some parasitic diseases. The results indicated an ovicidal action of Pythium oligandrum, supporting the prospects of its use in the decontamination methods of various surfaces or environments where ascarid eggs from carnivores are found.
Repurposing Avasimibe to Inhibit Bacterial Glycosyltransferases
Authors: Hasan Md Kamrul , El Qaidi Samir , McDonald Peter , Roy Anuradha , Hardwidge Philip R.
Published: March 2022

We are interested in identifying and characterizing small molecule inhibitors of bacterial virulence factors for their potential use as anti-virulence inhibitors. We identified from high-throughput screening assays a potential activity for avasimibe, a previously characterized acyl-coenzyme A: cholesterol acyltransferase inhibitor, in inhibiting the NleB and SseK arginine glycosyltransferases from Escherichia coli and Salmonella enterica, respectively. Avasimibe inhibited the activity of the Citrobacter rodentium NleB, E. coli NleB1, and S. enterica SseK1 enzymes, without affecting the activity of the human serine/threonine N-acetylglucosamine (O-GlcNAc) transferase. Avasimibe was not toxic to mammalian cells at up to 200 µM and was neither bacteriostatic nor bactericidal at concentrations of up to 125 µM. Doses of 10 µM avasimibe were sufficient to reduce S. enterica abundance in RAW264.7 macrophage-like cells, and intraperitoneal injection of avasimibe significantly reduced C. rodentium survival in mice, regardless of whether the avasimibe was administered pre- or post-infection. We propose that avasimibe or related derivates created using synthetic chemistry may have utility in preventing or treating bacterial infections by inhibiting arginine glycosyltransferases that are important to virulence.