bluuebunny/crossref_metadata_2025 huggingface dataset:
COVID-19—What Price Do Children Pay? An Analysis of Economic and Social Policy Factors
Authors: Lange Stephanie , Altrock Claire-Marie , Gossmann Emily , Fegert Jörg M. , Jud Andreas
Published: June 2022

Numerous studies have addressed the indirect consequences of the COVID-19 pandemic for children such as social isolation or increases in reported child maltreatment. Research on the economic and sociopolitical consequences is scarce as they can only be evaluated with a time lag. To improve our understanding of future, long-term developments in the context of the COVID-19 pandemic, we gathered findings from the still unexploited empirical literature on the aftermath of earlier pandemics, epidemics, and other infectious disease outbreaks. On top of this, we scrutinized research on past economic crises to interpret the link between changes in the economy and the health of children. Many of the side effects of battling the spread of the current pandemic, such as school closures, the stigma of infection, or conflicts about vaccines, are not novel and have already been documented in connection with previous infectious disease outbreaks. Results highlight that changes in the financial situation of families and socio-political challenges affect the situation and daily routine of children and youth in the long term. In consequence, the already pronounced socioeconomic inequalities will likely further increase. On top of this, due to reduced revenues, child protective services are likely to face challenges in the availability of human and financial resources.
The Association between Urinary Polycyclic Aromatic Hydrocarbons Metabolites and Type 2 Diabetes Mellitus
Authors: Wang Xue , Li Ang , Xu Qun
Published: June 2022

Polycyclic aromatic hydrocarbons (PAHs) are considered to be endocrine disruptors. In this study, the evidence on the association between PAHs and diabetes was systematically reviewed. PubMed, EMBASE, and ISI Web of Science were systematically searched for studies reporting the association between PAHs and diabetes. Of the 698 articles identified through the search, nine cross-sectional studies were included. Seven were conducted in the general population and two in coke oven workers. Fixed-effects and random-effects models were used to calculate the total effect. Subgroup analysis was further carried out according to the types of PAH metabolites. The results showed that the odds of diabetes were significantly higher for the highest category of urinary naphthalene (NAP), fluorine (FLU), phenanthrene (PHEN), and total mono-hydroxylated (OH-PAH) metabolites compared to the lowest category. The pooled odds ratios (OR) and 95% confidence intervals (CI) were 1.52 (95%CI: 1.19, 1.94), 1.53 (95%CI: 1.36, 1.71), 1.43 (95%CI: 1.28, 1.60), and 1.49 (95%CI: 1.07, 2.08), respectively. In coke oven workers, 4-hydroxyphenanthrene (4-OHPh) was significantly correlated with an increased risk of diabetes. Exposure measurements, outcome definitions, and adjustment for confounders were heterogeneous between studies. The results of the current study demonstrate a potentially adverse effect of PAHs on diabetes. Further mechanistic studies and longitudinal studies are needed to confirm whether PAH metabolite levels are causative, and hence associative, with increased diabetes incidences.
Shedding Light onto the City Blues Myth—The Potential of Stimulating and Activating Effects of Urban Public Spaces and the Role of City Relatedness
Authors: Lämmle Lena , von Lindern Eike , Rummel Dorothee , Michaeli Mark , Ziegler Matthias
Published: June 2022

The present study aims to investigate whether a sense of relatedness to a city helps to broaden understanding of the restorative potential of urban public spaces. Findings based on a sample of German adults (n = 249) confirm that people experience relatedness to a city. The study’s 3 × 3 (built, mixed, natural environment) × (average, livability environment, bird’s-eye view) design revealed disordinal interactions for being away, fascination, preference, mental fatigue, and stimulating and activating effects associated with cities. This implies that humans’ place perceptions are more complex than previously assumed. Both city and nature relatedness were relevant covariates of these findings. Surprisingly, the construct ‘activating effects’, was found to be mostly perceived as more positive for mixed and built environments compared to natural environments. Thus, complementing restorative environments research by introducing a measure for city relatedness significantly enhances understanding of the potential of urban public spaces for promoting human health and well-being.
Medical Education: Patients’ Perspectives on Clinical Training and Informed Consent
Authors: Gil-Santos Inês , Santos Cristina Costa , Duarte Ivone
Published: June 2022

There are complex ethical dilemmas inherent to medicine teaching, particularly in clinical practice involving actual patients. Questions must be raised on fulfilling medical students’ training needs while still respecting patients’ fundamental rights to autonomy and privacy. We aimed to assess patients’ perspectives regarding medical students’ involvement in their medical care. An observational, cross-sectional study was developed, and a questionnaire was applied randomly to patients waiting for a consultation/admitted to three distinct departments: General Surgery, Obstetrics/Gynaecology, and Infectious Diseases. Of the 77% interviewed patients who reported previous experiences with medical students, only 59% stated that they were asked for consent for their participation, and 28% stated that students had adequately introduced themselves. Patients from Gynaecology/Obstetrics were the ones who reported lower rates of these practices and were also the ones who were most bothered by students’ presence, stating that they would be more comfortable without the presence of medical students. Male patients received more explanations than female patients regarding the same matters. Thirty-five percent of patients stated that they would feel more comfortable without the medical students’ presence. The study shows a need to pay closer attention to fulfilling patients’ fundamental rights.
Association of Received Intergenerational Support with Subjective Well-Being among Elderly: The Mediating Role of Optimism and Sex Differences
Authors: Pan Zixin , Chen Ji-Kang
Published: June 2022

Even though an extensive body of previous research has examined the association between received intergenerational support and the well-being outcomes of older adults in a wide variety of contexts, few studies have been conducted to explore the impacts of intergenerational support on elders’ subjective well-being, especially the intermediary mechanisms in this process. The purpose of this study is to fill this gap by exploring the mediating role of optimism in the association between received intergenerational support and subjective well-being among the elderly in China, as well as the sex differences that exist between males and females. The findings show that the intergenerational support received from adult children is positively related to subjective well-being and that this relationship is partly mediated by optimism. Meanwhile, no significant sex difference was found in the interrelations between intergenerational support, optimism, and subjective well-being.
Antimicrobial Properties of TiO2 Microparticles Coated with Ca- and Cu-Based Composite Layers
Authors: Bucuresteanu Razvan , Ionita Monica , Chihaia Viorel , Ficai Anton , Trusca Roxana-Doina , Ilie Cornelia-Ioana , Kuncser Andrei , Holban Alina-Maria , Mihaescu Grigore , Petcu Gabriela , Nicolaev Adela , Costescu Ruxandra M. , Husch Mihai , Parvulescu Viorica , Ditu Lia-Mara
Published: June 2022

The ability of TiO2 to generate reactive oxygen species under UV radiation makes it an efficient candidate in antimicrobial studies. In this context, the preparation of TiO2 microparticles coated with Ca- and Cu-based composite layers over which Cu(II), Cu(I), and Cu(0) species were identified is presented here. The obtained materials were characterized by a wide range of analytical methods, such as X-ray diffraction, electron microscopy (TEM, SEM), X-ray photoelectron (XPS), and UV-VIS spectroscopy. The antimicrobial efficiency was evaluated using qualitative and quantitative standard methods and standard clinical microbial strains. A significant aspect of this composite is that the antimicrobial properties were evidenced both in the presence and absence of the light, as result of competition between photo and electrical effects. However, the antibacterial effect was similar in darkness and light for all samples. Because no photocatalytic properties were found in the absence of copper, the results sustain the antibacterial effect of the electric field (generated by the electrostatic potential of the composite layer) both under the dark and in light conditions. In this way, the composite layers supported on the TiO2 microparticles’ surface can offer continuous antibacterial protection and do not require the presence of a permanent light source for activation. However, the antimicrobial effect in the dark is more significant and is considered to be the result of the electric field effect generated on the composite layer.
Interplay between Zn2+ Homeostasis and Mitochondrial Functions in Cardiovascular Diseases and Heart Ageing
Authors: Dabravolski Siarhei A. , Sadykhov Nikolay K. , Kartuesov Andrey G. , Borisov Evgeny E. , Sukhorukov Vasily N. , Orekhov Alexander N.
Published: June 2022

Zinc plays an important role in cardiomyocytes, where it exists in bound and histochemically reactive labile Zn2+ forms. Although Zn2+ concentration is under tight control through several Zn2+-transporters, its concentration and intracellular distribution may vary during normal cardiac function and pathological conditions, when the protein levels and efficacy of Zn2+ transporters can lead to zinc re-distribution among organelles in cardiomyocytes. Such dysregulation of cellular Zn2+ homeostasis leads to mitochondrial and ER stresses, and interrupts normal ER/mitochondria cross-talk and mitophagy, which subsequently, result in increased ROS production and dysregulated metabolic function. Besides cardiac structural and functional defects, insufficient Zn2+ supply was associated with heart development abnormalities, induction and progression of cardiovascular diseases, resulting in accelerated cardiac ageing. In the present review, we summarize the recently identified connections between cellular and mitochondrial Zn2+ homeostasis, ER stress and mitophagy in heart development, excitation–contraction coupling, heart failure and ischemia/reperfusion injury. Additionally, we discuss the role of Zn2+ in accelerated heart ageing and ageing-associated rise of mitochondrial ROS and cardiomyocyte dysfunction.
Matrix Metalloproteinases and Their Inhibitors in Pulmonary Fibrosis: EMMPRIN/CD147 Comes into Play
Authors: Chuliá-Peris Lourdes , Carreres-Rey Cristina , Gabasa Marta , Alcaraz Jordi , Carretero Julián , Pereda Javier
Published: June 2022

Pulmonary fibrosis (PF) is characterized by aberrant extracellular matrix (ECM) deposition, activation of fibroblasts to myofibroblasts and parenchymal disorganization, which have an impact on the biomechanical traits of the lung. In this context, the balance between matrix metalloproteinases (MMPs) and their tissue inhibitors of metalloproteinases (TIMPs) is lost. Interestingly, several MMPs are overexpressed during PF and exhibit a clear profibrotic role (MMP-2, -3, -8, -11, -12 and -28), but a few are antifibrotic (MMP-19), have both profibrotic and antifibrotic capacity (MMP7), or execute an unclear (MMP-1, -9, -10, -13, -14) or unknown function. TIMPs are also overexpressed in PF; hence, the modulation and function of MMPs and TIMP are more complex than expected. EMMPRIN/CD147 (also known as basigin) is a transmembrane glycoprotein from the immunoglobulin superfamily (IgSF) that was first described to induce MMP activity in fibroblasts. It also interacts with other molecules to execute non-related MMP aactions well-described in cancer progression, migration, and invasion. Emerging evidence strongly suggests that CD147 plays a key role in PF not only by MMP induction but also by stimulating fibroblast myofibroblast transition. In this review, we study the structure and function of MMPs, TIMPs and CD147 in PF and their complex crosstalk between them.
Autoimmunity Related to Adipsic Hypernatremia and ROHHAD Syndrome
Authors: Nakamura-Utsunomiya Akari
Published: June 2022

Specific antibody responses to subfornical organs, including Nax antibody, have been reported in patients with adipsic hypernatremia of unknown etiology who do not have structural lesions in the hypothalamic–pituitary gland. The subfornical organ, also referred to as the window of the brain, is a sensing site that monitors sodium and osmotic pressure levels. On the other hand, ROHHAD syndrome is a rare disease for which the etiology of the hypothalamic disorder is unknown, and there have been some reports in recent years describing its association with autoimmune mechanisms. In addition, abnormal Na levels, including hypernatremia, are likely to occur in this syndrome. When comparing the clinical features of adipsic hypernatremia due to autoimmune mechanisms and ROHHAD syndrome, there are similar hypothalamic–pituitary dysfunction symptoms in addition to abnormal Na levels. Since clinical diagnoses of autoimmunological adipsic hypernatremia and ROHAD syndrome might overlap, we need to understand the essential etiology and carry out precise assessments to accurately diagnose patients and provide effective treatment. In this review, I review the literature on the autoimmune mechanism reported in recent years and describe the findings obtained so far and future directions.
DNA Methylation in Plant Responses and Adaption to Abiotic Stresses
Authors: Sun Minghui , Yang Zhuo , Liu Li , Duan Liu
Published: June 2022

Due to their sessile state, plants are inevitably affected by and respond to the external environment. So far, plants have developed multiple adaptation and regulation strategies to abiotic stresses. One such system is epigenetic regulation, among which DNA methylation is one of the earliest and most studied regulatory mechanisms, which can regulate genome functioning and induce plant resistance and adaption to abiotic stresses. In this review, we outline the most recent findings on plant DNA methylation responses to drought, high temperature, cold, salt, and heavy metal stresses. In addition, we discuss stress memory regulated by DNA methylation, both in a transient way and the long-term memory that could pass to next generations. To sum up, the present review furnishes an updated account of DNA methylation in plant responses and adaptations to abiotic stresses.
Multi-Step In Silico Discovery of Natural Drugs against COVID-19 Targeting Main Protease
Authors: Elkaeed Eslam B. , Youssef Fadia S. , Eissa Ibrahim H. , Elkady Hazem , Alsfouk Aisha A. , Ashour Mohamed L. , El Hassab Mahmoud A. , Abou-Seri Sahar M. , Metwaly Ahmed M.
Published: June 2022

In continuation of our antecedent work against COVID-19, three natural compounds, namely, Luteoside C (130), Kahalalide E (184), and Streptovaricin B (278) were determined as the most promising SARS-CoV-2 main protease (Mpro) inhibitors among 310 naturally originated antiviral compounds. This was performed via a multi-step in silico method. At first, a molecular structure similarity study was done with PRD_002214, the co-crystallized ligand of Mpro (PDB ID: 6LU7), and favored thirty compounds. Subsequently, the fingerprint study performed with respect to PRD_002214 resulted in the election of sixteen compounds (7, 128, 130, 156, 157, 158, 180, 184, 203, 204, 210, 237, 264, 276, 277, and 278). Then, results of molecular docking versus Mpro PDB ID: 6LU7 favored eight compounds (128, 130, 156, 180, 184, 203, 204, and 278) based on their binding affinities. Then, in silico toxicity studies were performed for the promising compounds and revealed that all of them have good toxicity profiles. Finally, molecular dynamic (MD) simulation experiments were carried out for compounds 130, 184, and 278, which exhibited the best binding modes against Mpro. MD tests revealed that luteoside C (130) has the greatest potential to inhibit SARS-CoV-2 main protease.
The nth-Order Comprehensive Adjoint Sensitivity Analysis Methodology for Nonlinear Systems (nth-CASAM-N): Mathematical Framework
Authors: Cacuci Dan Gabriel
Published: June 2022

This work presents the nth-Order Comprehensive Adjoint Sensitivity Analysis Methodology for Nonlinear Systems (nth-CASAM-N), which enables the most efficient computation of exactly determined expressions of arbitrarily high-order sensitivities of generic nonlinear system responses with respect to model parameters, uncertain boundaries, and internal interfaces in the model’s phase space. The mathematical framework underlying the nth-CASAM-N is proven to be correct by using mathematical induction. The nth-CASAM-N is formulated in linearly increasing higher-dimensional Hilbert spaces—as opposed to exponentially increasing parameter-dimensional spaces—thus overcoming the curse of dimensionality in sensitivity analysis of nonlinear systems.
Formation Mechanism and Lattice Parameter Investigation for Copper-Substituted Cobalt Ferrites from Zingiber officinale and Elettaria cardamom Seed Extracts Using Biogenic Route
Authors: Barkat Faiqa , Afzal Marina , Khan Babar Shahzad , Saeed Adnan , Bashir Mahwish , Mukhtar Aiman , Mehmood Tahir , Wu Kaiming
Published: June 2022

Biogenic routes for the synthesis of nanoparticles are environmentally friendly, nontoxic, biocompatible, and cost-effective compared to traditional synthesis methods. In this study, cobalt ferrite was synthesized using Zingiber officinale and Elettaria cardamom Seed extracts. Effect of copper contents (x = 0.0, 0.3, 0.6 and 0.9) on the plant extracted Cux(Co1−xFe2O4) was investigated by XRD, SEM, EDX, UV-Vis., PL, FE-SEM, FTIR and photocatalytic activity. XRD results revealed that nanoparticles exhibit a cubical spinel structure with an average diameter of 7–45 nm, calculated by the Debye Scherer formula. The value of the lattice parameter decreased from 8.36 Å to 8.08 Å with substitution of copper, which can be attributed to mismatch of ionic radii of Cu2+ (0.73 Å) and Co2+ (0.74 Å) ions. SEM analysis showed that nanoparticles exhibit a spherical shape (~13 nm diameter) for undoped samples and low Cu concentration, while they changed to a hexagonal structure at higher Cu concentration (x = 0.9) with a diameter ~46 nm and a decreased degree of agglomeration. FE-SEM further confirmed the nanoparticles’ size and shape. EDX analysis confirmed the presence of cobalt, iron, and oxygen without contamination. The optical absorption spectra of UV-vis and PL showed red-shift, which can be accredited to larger crystalline sizes of nanoparticles. FTIR spectra showed two main bands at 410 and 605 cm−1, indicating the presence of intrinsic vibrations of the octahedral and tetrahedral complexes, respectively. The photocatalytic activity of Co0.4Cu0.6 Fe2O4 nanoparticles was investigated using methylene blue (MB) and methyl orange (MO) dyes under visible light irradiation. The degradation rate (93.39% and 83.15%), regression correlation coefficient (0.9868 and 0.9737) and rate constant (0.04286 and 0.03203 rate·min−1) were calculated for MB and MO, respectively. Mechanisms for the formation and photocatalytic activity of Cu-substituted plant-extracted cobalt ferrite were discussed. The Co0.4Cu0.6 Fe2O4 nanoferrite was found to be an efficient photocatalyst, and can be exploited for wastewater treatment applications for MB/MO elimination.
Concrete Durability after Load Damage and Salt Freeze–Thaw Cycles
Authors: Zhou Jiguo , Wang Guihua , Liu Peng , Guo Xuefeng , Xu Jun
Published: June 2022

To determine how the performance of concrete changes after initial load damage and salt freezing, concrete samples were first subjected to loading and unloading, and were then put into salt solutions to carry out rapid freeze–thaw cycle (FTC) experiments. Salt solutions were created based on the saline soil of western Jilin, China, for use in salt freeze–thaw testing. This determined the change law of the compressive strength and the dynamic elastic modulus (DEM). Additionally, low-field nuclear magnetic resonance technology and a scanning electron microscope were applied to investigate the pore characteristics and microstructure of concrete samples after FTCs. This study found that when the concrete specimens were subjected to an initial load of 0.3f under 50 FTCs, the loss in the compressive strength increased by 24% when the concrete was subjected to freeze–thaw cycles in freshwater and increased by 24% when concrete was subjected to freeze–thaw cycles in a 6.8% composite salt solution compared with the specimens without the initial load. When the concrete was subjected to FTCs in a 6.8% composite salt solution 50 times, the loss in the compressive strength increased by 110% for concrete without an initial load and increased by 109% when the concrete was subjected to an initial load of 0.3f compared with the specimens under FTCs in freshwater. The persistent effect of the FTCs also aggravated chloride ion erosion in the concrete, which gradually reduced the concrete’s permeability resistance. Internal pores in the concrete, especially the proportion of above-medium-sized pores, gradually increased along with the increase in the number of FTCs. There is a good linear correlation between the change rule of compressive mechanical properties and the change rules of mass, DEM, and pore characteristics inside the concrete under rapid FTCs in different salt solutions.
Both Plasticizing and Air-Entraining Effect on Cement-Based Material Porosity and Durability
Authors: Tolegenova Aigerim , Skripkiunas Gintautas , Rishko Lyudmyla , Akmalaiuly Kenzhebek
Published: June 2022

The influence of a complex application of both plasticizing and air-entraining effects on concrete with polycarboxylate ether superplasticizer (PCE), air-entraining admixture (AIR), or an anti-foaming agent (AF) is analyzed in this paper with considerations for on the air content, workability, flexural and compressive strength, and freezing–thawing resistance of hardened cement mixtures. The effect of the complex behavior of PCE, AIR, and AF on the porosity of hardened cement mortar (HCM) and freezing–thawing resistance was investigated; freezing–thawing resistance prediction methodology for plasticized mortar was also evaluated. The results presented in the article demonstrate the beneficial influence of entrained air content on consistency and stability of cement mortar, closed porosity, and durability of concrete. Freezing–thawing factor KF depending on porosity parameters can be used for freezing–thawing resistance prediction. With both plasticizing (decrease in the water–cement ratio) and air-entraining effects (increase in the amount of entrained air content), the frost resistance of concrete increases, scaling decreases exponentially, and it is possible to obtain great frost resistance for cement-based material.
Investigation on the Interface Morphology of Mg/Al Corrugated Composite Plate in the Straightening Process
Authors: Xing Tong , Liu Cuirong , Liu Jie , Gui Hailian , Hu Xiaotong , Chu Zhibing , Tuo Leifeng
Published: June 2022

The Mg/Al composite plate was developed in aerospace and other fields. At present, through the corrugated rolling method, the bonding strength of Mg/Al composite plate could be increased and the warpage could be reduced. However, this still requires the straightening process to reach the parameters’ range. In this work, the original interface morphology of Mg/Al corrugated composite plate was obtained by experimental characterization. Based on the principle of elastoplastic mechanics, the equations of straightener parameters and straightening process parameters were obtained and the influencing factors were deduced. So, the straightening model was established in an Abaqus. The effects of straightener parameters and straightening process parameters on the interface morphology were analyzed and the interface morphology was expressed by amplitude and period length of the equation. The results showed that bending moment, shear strength and the reduction of second roll played roles on the interface morphology. After the first straightening unit, the amplitude increased by 1.1% and the period length increased by 3%. Finally, a complete straightening parameter was designed, which included straightener parameters, straightening process parameters and straightening temperature. The aim of this work was to provide a theoretical basis for establishing a high precision Mg/Al corrugated composite plate straightening model, which could improve the bonding strength while ensuring the straightening effect.
Structural Features and Defect Equilibrium in Cubic PrBa1−xSrxFe2O6−δ
Authors: Leonidov Ilia A. , Markov Alexey A. , Zavyalov Mikhail A. , Merkulov Oleg V. , Shalaeva Elisaveta V. , Nikitin Sergey S. , Tsipis Ekaterina V. , Patrakeev Mikhail V.
Published: June 2022

The structure, oxygen non-stoichiometry, and defect equilibrium in perovskite-type PrBa1−xSrxFe2O6−δ (x = 0, 0.25, 0.50) synthesized at 1350 °C were studied. For all compositions, X-ray diffraction testifies to the formation of a cubic structure (S.G. Pm3¯m), but an electron diffraction study reveals additional diffuse satellites around each Bragg spot, indicating the primary incommensurate modulation with wave vectors about ±0.43a*. The results were interpreted as a sign of the short-order in both A-cation and anion sublattices in the areas of a few nanometers in size, and of an intermediate state before the formation of an ordered superstructure. An increase in oxygen deficiency was found to promote the ordering, whereas partial substitution of barium by strontium caused the opposite effect. The oxygen content in oxides as a function of oxygen partial pressure and temperature was measured by coulometric titration, and the data were used for the modeling of defect equilibrium in oxides. The simulation results implied oxygen vacancy ordering in PrBa1−xSrxFe2O6−δ that is in agreement with the electron diffraction study. Besides oxidation and charge disproportionation reactions, the reactions of oxygen vacancy distribution between non-equivalent anion positions, and their trapping in clusters with Pr3+ ions were taken into account by the model. It was demonstrated that an increase in the strontium content in Pr0.5Ba0.5−xSrxFeO3−δ suppressed ordering of oxygen vacancies, increased the binding energy of oxygen ions in the oxides, and resulted in an increase in the concentration of p-type carriers.
Curing Effect on Durability of Cement Mortar with GGBS: Experimental and Numerical Study
Authors: Ghostine Rabih , Bur Nicolas , Feugeas Françoise , Hoteit Ibrahim
Published: June 2022

In this paper, supplementary cementitious materials are used as a substitute for cement to decrease carbon dioxide emissions. A by-product of the iron manufacturing industry, ground granulated blast-furnace slag (GGBS), known to improve some performance characteristics of concrete, is used as an effective cement replacement to manufacture mortar samples. Here, the influence of curing conditions on the durability of samples including various amounts of GGBS is investigated experimentally and numerically. Twelve high-strength Portland cement CEM I 52.5 N samples were prepared, in which 0%, 45%, 60%, and 80% of cement were substituted by GGBS. In addition, three curing conditions (standard, dry, and cold curing) were applied to the samples. Durability aspects were studied through porosity, permeability, and water absorption. Experimental results indicate that samples cured in standard conditions gave the best performance in comparison to other curing conditions. Furthermore, samples incorporating 45% of GGBS have superior durability properties. Permeability and water absorption were improved by 17% and 18%, respectively, compared to the reference sample. Thereafter, data from capillary suction experiments were used to numerically determine the hydraulic properties based on a Bayesian inversion approach, namely the Markov Chain Monte Carlo method. Finally, the developed numerical model accurately estimates the hydraulic characteristics of mortar samples and greatly matches the measured water inflow over time through the samples.
Hexagonal Boron Nitride on III–V Compounds: A Review of the Synthesis and Applications
Authors: Yang Yufei , Peng Yi , Saleem Muhammad Farooq , Chen Ziqian , Sun Wenhong
Published: June 2022

Since the successful separation of graphene from its bulk counterpart, two-dimensional (2D) layered materials have become the focus of research for their exceptional properties. The layered hexagonal boron nitride (h-BN), for instance, offers good lubricity, electrical insulation, corrosion resistance, and chemical stability. In recent years, the wide-band-gap layered h-BN has been recognized for its broad application prospects in neutron detection and quantum information processing. In addition, it has become very important in the field of 2D crystals and van der Waals heterostructures due to its versatility as a substrate, encapsulation layer, and a tunneling barrier layer for various device applications. However, due to the poor adhesion between h-BN and substrate and its high preparation temperature, it is very difficult to prepare large-area and denseh-BN films. Therefore, the controllable synthesis of h-BN films has been the focus of research in recent years. In this paper, the preparation methods and applications of h-BN films on III–V compounds are systematically summarized, and the prospects are discussed.
Remineralization Efficacy of Four Remineralizing Agents on Artificial Enamel Lesions: SEM-EDS Investigation
Authors: Vitiello Flavia , Tosco Vincenzo , Monterubbianesi Riccardo , Orilisi Giulia , Gatto Maria Laura , Sparabombe Scilla , Memé Lucia , Mengucci Paolo , Putignano Angelo , Orsini Giovanna
Published: June 2022

Dental remineralization represents the process of depositing calcium and phosphate ions into crystal voids in demineralized enamel, producing net mineral gain and preventing early enamel lesions progression. The aim of the present study was to qualitatively and quantitatively compare the remineralizing effectiveness of four commercially available agents on enamel artificial lesions using Scanning Electron Microscopy (SEM) combined with Energy Dispersive Spectroscopy (EDS) techniques. Thirty-six extracted third molars were collected and randomly assigned to six groups (n = 6), five of which were suspended in demineralizing solution for 72 h to create enamel artificial lesions, and one serving as control: G1, treated with a mousse of casein phosphopeptide and amorphous calcium–phosphate (CPP-ACP); G2, treated with a gel containing nano-hydroxyapatite; G3, treated with a 5% SF varnish; G4, treated with a toothpaste containing ACP functionalized with fluoride and carbonate-coated with citrate; G5, not-treated artificial enamel lesions; G6, not demineralized and not treated sound enamel. G1–G4 were subjected to pH cycling over a period of seven days. Analyses of the specimens’ enamel surfaces morphology were performed by SEM and EDS. Data were statistically analyzed for multiple group comparison by one-way ANOVA/Tukey’s test (p < 0.05). The results show that the Ca/P ratio of the G5 (2.00 ± 0.07) was statistically different (p < 0.05) from G1 (1.73 ± 0.05), G2 (1.76 ± 0.01), G3 (1.88 ± 0.06) and G6 (1.74 ± 0.04), while there were no differences (p > 0.05) between G1, G2 and G6 and between G4 (2.01 ± 0.06) and G5. We concluded that G1 and G2 showed better surface remineralization than G3 and G4, after 7 days of treatment.
Design and Control of Magnetic Shape Memory Alloy Actuators
Authors: Minorowicz Bartosz , Milecki Andrzej
Published: June 2022

This paper presents research on the application of magnetic shape memory alloys (MSMAs) in actuator design. MSMAs are a relatively new group of so-called smart materials that are distinguished by repeatable strains up to 6% and dynamics much better than that of thermally activated shape memory alloys (SMAs). The shape change mechanism in MSMAs is based on the rearrangement of martensite cells in the presence of an external magnetic field. In the first part of the article a review of the current state of MSMA actuator design is presented, followed by a description of the design, modelling and control of a newly proposed actuator. The developed actuator works with MSMA samples of 3 × 10 × 32 mm3, guaranteeing an available operating range of up to 1 mm, despite its great deformation range and dynamics. In the paper its dynamics model is proposed and its transfer function is derived. Moreover, the generalised Prandtl-Ishlinskii model of MSMA-actuator hysteresis is proposed. This model is then inverted and used in the control system for hysteresis compensation. A special test stand was designed and built to test the MSMA actuator with compensation. The step responses are recorded, showing that the compensated MSMA actuator exhibits the positioning accuracy as ±2 µm. As a result, the authors decided to apply a control system based on an inverse hysteresis model. The paper concludes with a summary of the research results, with theoretical analysis compared with the registered actuator characteristics.
Superhydrophobic Modification of Biomass Cuttlebone Applied to Oil Spill Remediation
Authors: Xu Junfei , Che Pengchao , Zhang Hailong , Zhang Yuliang , Wu Jun , Li Weiqi , He Jizhong , Ma Zhihui , Li Tengfei , Dong Yunyuan , Yu Jianping , Tong Ruiping
Published: June 2022

The spills of crude oil and other organic chemicals are common around the world, resulting in severe damage to the environment and ecosystem. Therefore, developing low-cost and eco-friendly absorption material is in urgent need. In this study, we report a superhydrophobic and oleophilic porous material using biomass cuttlebone as the scaffold. A layer of polydopamine is grafted on the cuttlebone as the adhesion layer between the cuttlebone and the superhydrophobic coating. The in situ grown silica micro/nanoparticles on top of the adhesion layer provide the anchoring spots for grafting the fluorinated hydrocarbon and a rough topography for realizing superhydrophobicity. The static water contact angle of the superhydrophobic cuttlebone reaches 152°, and its oil contact angle is ~0°. The excellent oil–water separation efficiency of the prepared superhydrophobic cuttlebone is demonstrated using high-density oil/water mixtures and low-density oil/water mixtures.
Syngas Fermentation to Acetate and Ethanol with Adaptative Electroactive Carboxydotrophs in Single Chambered Microbial Electrochemical System
Authors: Tharak Athmakuri , Mohan S. Venkata
Published: June 2022

Microbial electrosynthesis system (MES; single-chambered) was fabricated and evaluated with carbon cloth/graphite as a working/counter electrode employing an enriched microbiome. Continuous syngas sparging (at working electrode; WE) enabled the growth of endo electrogenic bacteria by availing the inorganic carbon source. Applied potential (−0.5 V) on the working electrode facilitated the reduction in syngas, leading to the synthesis of fatty acids and alcohols. The higher acetic acid titer of 3.8 g/L and ethanol concentration of 0.2 g/L was observed at an active microbial metabolic state, evidencing the shift in metabolism from acetogenic to solventogenesis. Voltammograms evidenced distinct redox species with low charge transfer resistance (Rct; Nyquist impedance). Reductive catalytic current (−0.02 mA) enabled the charge transfer efficiency of the cathodes favoring syngas conversion to products. The surface morphology of carbon cloth and system-designed conditions favored the growth of electrochemically active consortia. Metagenomic analysis revealed the enrichment of phylum/class with Actinobacteria, Firmicutes/Clostridia and Bacilli, which accounts for the syngas fermentation through suitable gene loci.
Microfiber Contamination in Potable Water: Detection and Mitigation Using a Filtering Device
Authors: Volgare Michela , Avolio Roberto , Castaldo Rachele , Errico Maria Emanuela , El Khiar Hakim , Gentile Gennaro , Sinjur Andreja , Susnik Danilo , Znidarsic Andrej , Cocca Mariacristina
Published: June 2022

In recent years, microfibers released from synthetic fabrics have been identified as the main contributor to primary microplastic pollution. These pollutants have been detected in several products for human consumption. This work aims to evaluate the efficiency of a specific device used with the purpose to monitor and reduce this anthropogenic pollution in potable water. The device was tested using potable water from several cities in Slovenia by mounting the device containing the porous membrane directly to the faucet in private and public buildings. The results highlight the effectiveness of the applied device in removing natural and synthetic microfibers from tap water and confirm the abundance of microfibers as a contaminant of potable water.
Modeling of Anticancer Sulfonamide Derivatives Lipophilicity by Chemometric and Quantitative Structure-Retention Relationships Approaches
Authors: Pastewska Monika , Żołnowska Beata , Kovačević Strahinja , Kapica Hanna , Gromelski Maciej , Stoliński Filip , Sławiński Jarosław , Sawicki Wiesław , Ciura Krzesimir
Published: June 2022

Sulfonamides are a classic group of chemotherapeutic drugs with a broad spectrum of pharmacological action, including anticancer activity. In this work, reversed-phase high-performance liquid chromatography and biomimetic chromatography were applied to characterize the lipophilicity of sulfonamide derivatives with proven anticancer activities against human colon cancer. Chromatographically determined lipophilicity parameters were compared with obtained logP, employing various computational approaches. Similarities and dissimilarities between experimental and computational logP were studied using principal component analysis, cluster analysis, and the sum of ranking differences. Furthermore, quantitative structure–retention relationship modeling was applied to understand the influences of sulfonamide’s molecular properties on lipophilicity and affinity to phospholipids.
Determining Repulsion in Cyclophane Cages
Authors: Jabłoński Mirosław
Published: June 2022

Superphane, i.e., [2.2.2.2.2.2](1,2,3,4,5,6)cyclophane, is a very convenient molecule in studying the nature of guest⋯host interactions in endohedral complexes. Nevertheless, the presence of as many as six ethylene bridges in the superphane molecule makes it practically impossible for the trapped entity to escape out of the superphane cage. Thus, in this article, I have implemented the idea of using the superphane derivatives with a reduced number of ethylene linkers, which leads to the [2n] cyclophanes where n<6. Seven such cyclophanes are then allowed to form endohedral complexes with noble gas (Ng) atoms (He, Ne, Ar, Kr). It is shown that in the vast majority of cases, the initially trapped Ng atom spontaneously escapes from the cyclophane cage, creating an exohedral complex. This is the best proof that the Ng⋯cyclophane interaction in endohedral complexes is indeed highly repulsive, i.e., destabilizing. Apart from the ‘sealed’ superphane molecule, endohedral complexes are only formed in the case of the smallest He atom. However, it has been shown that in these cases, the Ng⋯cyclophane interaction inside the cyclophane cage is nonbonding, i.e., repulsive. This highly energetically unfavorable effect causes the cyclophane molecule to ‘swell’.
Computational Study of Asian Propolis Compounds as Potential Anti-Type 2 Diabetes Mellitus Agents by Using Inverse Virtual Screening with the DIA-DB Web Server, Tanimoto Similarity Analysis, and Molecular Dynamic Simulation
Authors: Syaifie Putri Hawa , Harisna Azza Hanif , Nasution Mochammad Arfin Fardiansyah , Arda Adzani Gaisani , Nugroho Dwi Wahyu , Jauhar Muhammad Miftah , Mardliyati Etik , Maulana Nurwenda Novan , Rochman Nurul Taufiqu , Noviyanto Alfian , Banegas-Luna Antonio J. , Pérez-Sánchez Horacio
Published: June 2022

Propolis contains a wide range of pharmacological activities because of their various bioactive compounds. The beneficial effect of propolis is interesting for treating type-2 diabetes mellitus (T2DM) owing to dysregulation of multiple metabolic processes. In this study, 275 of 658 Asian propolis compounds were evaluated as potential anti-T2DM agents using the DIA-DB web server towards 18 known anti-diabetes protein targets. More than 20% of all compounds could bind to more than five diabetes targets with high binding affinity (<−9.0 kcal/mol). Filtering with physicochemical and pharmacokinetic properties, including ADMET parameters, 12 compounds were identified as potential anti-T2DM with favorable ADMET properties. Six of those compounds, (2R)-7,4′-dihydroxy-5-methoxy-8-methylflavone; (RR)-(+)-3′-senecioylkhellactone; 2′,4′,6′-trihydroxy chalcone; alpinetin; pinobanksin-3-O-butyrate; and pinocembrin-5-methyl ether were first reported as anti-T2DM agents. We identified the significant T2DM targets of Asian propolis, namely retinol-binding protein-4 (RBP4) and aldose reductase (AKR1B1) that have important roles in insulin sensitivity and diabetes complication, respectively. Molecular dynamic simulations showed stable interaction of selected propolis compounds in the active site of RBP4 and AKR1B1. These findings suggest that Asian propolis compound may be effective for treatment of T2DM by targeting RBP4 and AKR1B1.
Estrogen-Related Receptor α: A Significant Regulator and Promising Target in Bone Homeostasis and Bone Metastasis
Authors: Feng Chun , Xu Zhaowei , Tang Xiaojie , Cao Haifei , Zhang Guilong , Tan Jiangwei
Published: June 2022

Bone homeostasis is maintained with the balance between bone formation and bone resorption, which is involved in the functional performance of osteoblast and osteoclast. Disruption of this equilibrium usually causes bone disorders including osteoporosis, osteoarthritis, and osteosclerosis. In addition, aberrant activity of bone also contributes to the bone metastasis that frequently occurs in the late stage of aggressive cancers. Orphan nuclear receptor estrogen-related receptor (ERRα) has been demonstrated to control the bone cell fate and the progression of tumor cells in bone through crosstalk with various molecules and signaling pathways. However, the defined function of this receptor in bone is inconsistent and controversial. Therefore, we summarized the latest research and conducted an overview to reveal the regulatory effect of ERRα on bone homeostasis and bone metastasis, this review may broaden the present understanding of the cellular and molecular model of ERRα and highlight its potential implication in clinical therapy.
Deproteinization of Chitin Extracted with the Help of Ionic Liquids
Authors: Lyon Douglas R. , Smith Bryan R. , Abidi Noureddine , Shamshina Julia L.
Published: June 2022

The isolation of chitin utilizing ionic liquid 1-ethyl-3-methylimidazolium acetate has been determined to result in polymer contaminated with proteins. For the first time, the proteins in chitin extracted with ionic liquid have been quantified; the protein content was found to vary from 1.3 to 1.9% of the total weight. These proteins were identified and include allergenic proteins such as tropomyosin. In order to avoid ‘traditional’ hydroxide-based deproteinization of chitin, which could reduce the molecular weight of the final product, alternative deproteinization strategies were attempted. Testing of the previously reported deproteinization method using aqueous K3PO4 resulted in protein reduction by factors varying from 2 to 10, but resulted in significant phosphate salt contamination of the final product. Contrarily, the incorporation of GRAS (Generally Recognized as Safe) compound Polysorbate 80 into the polymer washing step provided the polymer of comparable purity with no contaminants. This study presents new options for the deproteinization of chitin that can replace traditional approaches with methods that are environmentally friendly and can produce high purity polymer.
(-)-α-Bisabolol Alleviates Atopic Dermatitis by Inhibiting MAPK and NF-κB Signaling in Mast Cell
Authors: Li Guangxia , Wu Huayan , Sun Liqin , Cheng Kang , Lv Zhi , Chen Kaixian , Qian Fei , Li Yiming
Published: June 2022

(-)-α-Bisabolol (BIS) is a sesquiterpene alcohol derived mostly from Matricaria recutita L., which is a traditional herb and exhibits multiple biologic activities. BIS has been reported for treatment of skin disorders, but the effect of BIS on anti-atopic dermatitis (AD) remains unclear. Therefore, we investigated the effects of BIS on 2,4-dinitrochlorobenzene (DNCB)-induced AD in BALB/c mice and the underlying mechanism in Bone Marrow-Derived Mast Cells (BMMCs). Topical BIS treatment reduced AD-like symptoms and the release of interleukin (IL)-4 without immunoglobulin (Ig)-E production in DNCB-induced BALB/c mice. Histopathological examination revealed that BIS reduced epidermal thickness and inhibited mast cells in the AD-like lesions skin. Oral administration of BIS effectively and dose-dependently suppressed mast-cell-mediated passive cutaneous anaphylaxis. In IgE-mediated BMMCs, the levels of β-hexosaminidase (β-hex), histamine, and tumor necrosis factor (TNF)-α were reduced by blocking the activation of nuclear factor-қB (NF-қB) and c-Jun N-terminal kinase (JNK) without P38 mitogen activated protein (P38) and extracellular regulated protein kinases (Erk1/2). Taken together, our experimental results indicated BIS suppresses AD by inhibiting the activation of JNK and NF-κB in mast cells. BIS may be a promising therapeutic agent for atopic dermatitis and other mast-cell-related diseases.
Correction: Wang et al. Polycyclic Polyprenylated Acylphloroglucinol Derivatives from Hypericum acmosepalum. Molecules 2019, 24, 50
Authors: Wang Jiao , Shi Mengjiao , Wang Jiajia , Li Jin , Ji Tengfei
Published: June 2022

The authors wish to make the following correction to their paper [...]
Innovative Materials for Energy Storage and Conversion
Authors: Li Shi , Luo Shi , Rong Liya , Wang Linqing , Xi Ziyang , Liu Yong , Zhou Yuheng , Wan Zhongmin , Kong Xiangzhong
Published: June 2022

The metal chalcogenides (MCs) for sodium-ion batteries (SIBs) have gained increasing attention owing to their low cost and high theoretical capacity. However, the poor electrochemical stability and slow kinetic behaviors hinder its practical application as anodes for SIBs. Hence, various strategies have been used to solve the above problems, such as dimensions reduction, composition formation, doping functionalization, morphology control, coating encapsulation, electrolyte modification, etc. In this work, the recent progress of MCs as electrodes for SIBs has been comprehensively reviewed. Moreover, the summarization of metal chalcogenides contains the synthesis methods, modification strategies and corresponding basic reaction mechanisms of MCs with layered and non-layered structures. Finally, the challenges, potential solutions and future prospects of metal chalcogenides as SIBs anode materials are also proposed.