bluuebunny/crossref_metadata_2025 huggingface dataset:
Interrelated Mechanism by Which the Methide Quinone Celastrol, Obtained from the Roots of Tripterygium wilfordii, Inhibits Main Protease 3CLpro of COVID-19 and Acts as Superoxide Radical Scavenger
Authors: Caruso Francesco , Singh Manrose , Belli Stuart , Berinato Molly , Rossi Miriam
Published: December 2020

We describe the potential anti coronavirus disease 2019 (COVID-19) action of the methide quinone inhibitor, celastrol. The related methide quinone dexamethasone is, so far, among COVID-19 medications perhaps the most effective drug for patients with severe symptoms. We observe a parallel redox biology behavior between the antioxidant action of celastrol when scavenging the superoxide radical, and the adduct formation of celastrol with the main COVID-19 protease. The related molecular mechanism is envisioned using molecular mechanics and dynamics calculations. It proposes a covalent bond between the S(Cys145) amino acid thiolate and the celastrol A ring, assisted by proton transfers by His164 and His41 amino acids, and a π interaction from Met49 to the celastrol B ring. Specifically, celastrol possesses two moieties that are able to independently scavenge the superoxide radical: the carboxylic framework located at ring E, and the methide-quinone ring A. The latter captures the superoxide electron, releasing molecular oxygen, and is the feature of interest that correlates with the mechanism of COVID-19 inhibition. This unusual scavenging of the superoxide radical is described using density functional theory (DFT) methods, and is supported experimentally by cyclic voltammetry and X-ray diffraction.
Cancer-Associated Muscle Wasting—Candidate Mechanisms and Molecular Pathways
Authors: Armstrong Victoria S. , Fitzgerald Liam W. , Bathe Oliver F.
Published: December 2020

Excessive muscle loss is commonly observed in cancer patients and its association with poor prognosis has been well-established. Cancer-associated sarcopenia differs from age-related wasting in that it is not responsive to nutritional intervention and exercise. This is related to its unique pathogenesis, a result of diverse and interconnected mechanisms including inflammation, disordered metabolism, proteolysis and autophagy. There is a growing body of evidence that suggests that the tumor is the driver of muscle wasting by its elaboration of mediators that influence each of these pro-sarcopenic pathways. In this review, evidence for these tumor-derived factors and putative mechanisms for inducing muscle wasting will be reviewed. Potential targets for future research and therapeutic interventions will also be reviewed.
Fucoidans as Potential Therapeutics for Age-Related Macular Degeneration—Current Evidence from In Vitro Research
Authors: Dörschmann Philipp , Klettner Alexa
Published: December 2020

Age-related macular degeneration (AMD) is the major reason for blindness in the industrialized world with limited treatment options. Important pathogenic pathways in AMD include oxidative stress and vascular endothelial growth factor (VEGF) secretion. Due to their bioactivities, fucoidans have recently been suggested as potential therapeutics. This review gives an overview of the recent developments in this field. Recent studies have characterized several fucoidans from different species, with different molecular characteristics and different extraction methods, in regard to their ability to reduce oxidative stress and inhibit VEGF in AMD-relevant in vitro systems. As shown in these studies, fucoidans exhibit a species dependency in their bioactivity. Additionally, molecular properties such as molecular weight and fucose content are important issues. Fucoidans from Saccharina latissima and Laminaria hyperborea were identified as the most promising candidates for further development. Further research is warranted to establish fucoidans as potential therapeutics for AMD.
Fucoxanthin, a Marine-Derived Carotenoid from Brown Seaweeds and Microalgae: A Promising Bioactive Compound for Cancer Therapy
Authors: Méresse Sarah , Fodil Mostefa , Fleury Fabrice , Chénais Benoît
Published: December 2020

Fucoxanthin is a well-known carotenoid of the xanthophyll family, mainly produced by marine organisms such as the macroalgae of the fucus genus or microalgae such as Phaeodactylum tricornutum. Fucoxanthin has antioxidant and anti-inflammatory properties but also several anticancer effects. Fucoxanthin induces cell growth arrest, apoptosis, and/or autophagy in several cancer cell lines as well as in animal models of cancer. Fucoxanthin treatment leads to the inhibition of metastasis-related migration, invasion, epithelial–mesenchymal transition, and angiogenesis. Fucoxanthin also affects the DNA repair pathways, which could be involved in the resistance phenotype of tumor cells. Moreover, combined treatments of fucoxanthin, or its metabolite fucoxanthinol, with usual anticancer treatments can support conventional therapeutic strategies by reducing drug resistance. This review focuses on the current knowledge of fucoxanthin with its potential anticancer properties, showing that fucoxanthin could be a promising compound for cancer therapy by acting on most of the classical hallmarks of tumor cells.
Unpatterned Bioactive Poly(Butylene 1,4-Cyclohexanedicarboxylate)-Based Film Fast Induced Neuronal-Like Differentiation of Human Bone Marrow-Mesenchymal Stem Cells
Authors: Morena Francesco , Argentati Chiara , Soccio Michelina , Bicchi Ilaria , Luzi Francesca , Torre Luigi , Munari Andrea , Emiliani Carla , Gigli Matteo , Lotti Nadia , Armentano Ilaria , Martino Sabata
Published: December 2020

Herein, we present poly(butylene 1,4-cyclohexanedicarboxylate) (PBCE) films characterized by an unpatterned microstructure and a specific hydrophobicity, capable of boosting a drastic cytoskeleton architecture remodeling, culminating with the neuronal-like differentiation of human bone marrow-mesenchymal stem cells (hBM-MSCs). We have used two different filming procedures to prepare the films, solvent casting (PBCE) and compression-moulding (PBCE*). PBCE film had a rough and porous surface with spherulite-like aggregations (Ø = 10–20 μm) and was characterized by a water contact angle = 100°. PBCE* showed a smooth and continuous surface without voids and visible spherulite-like aggregations and was more hydrophobic (WCA = 110°). Both surface characteristics were modulated through the copolymerization of different amounts of ether-oxygen-containing co-units into PBCE chemical structure. We showed that only the surface characteristics of PBCE-solvent-casted films steered hBM-MSCs toward a neuronal-like differentiation. hBM-MSCs lost their canonical mesenchymal morphology, acquired a neuronal polarized shape with a long cell protrusion (≥150 μm), expressed neuron-specific class III β-tubulin and microtubule-associated protein 2 neuronal markers, while nestin, a marker of uncommitted stem cells, was drastically silenced. These events were observed as early as 2-days after cell seeding. Of note, the phenomenon was totally absent on PBCE* film, as hBM-MSCs maintained the mesenchymal shape and behavior and did not express neuronal/glial markers.
Crowd Counting Guided by Attention Network
Authors: Nie Pei , Fan Cien , Zou Lian , Chen Liqiong , Li Xiaopeng
Published: December 2020

Crowd Crowd counting is not simply a matter of counting the numbers of people, but also requires that one obtains people’s spatial distribution in a picture. It is still a challenging task for crowded scenes, occlusion, and scale variation. This paper proposes a global and local attention network (GLANet) for efficient crowd counting, which applies an attention mechanism to enhance the features. Firstly, the feature extractor module (FEM) uses the pertained VGG-16 to parse out a simple feature map. Secondly, the global and local attention module (GLAM) effectively captures the local and global attention information to enhance features. Thirdly, the feature fusing module (FFM) applies a series of convolutions to fuse various features, and generate density maps. Finally, we conduct some experiments on a mainstream dataset and compare them with state-of-the-art methods’ performances.
Task-Driven Learned Hyperspectral Data Reduction Using End-to-End Supervised Deep Learning
Authors: Zeegers Mathé T. , Pelt Daniël M. , van Leeuwen Tristan , van Liere Robert , Batenburg Kees Joost
Published: December 2020

An important challenge in hyperspectral imaging tasks is to cope with the large number of spectral bins. Common spectral data reduction methods do not take prior knowledge about the task into account. Consequently, sparsely occurring features that may be essential for the imaging task may not be preserved in the data reduction step. Convolutional neural network (CNN) approaches are capable of learning the specific features relevant to the particular imaging task, but applying them directly to the spectral input data is constrained by the computational efficiency. We propose a novel supervised deep learning approach for combining data reduction and image analysis in an end-to-end architecture. In our approach, the neural network component that performs the reduction is trained such that image features most relevant for the task are preserved in the reduction step. Results for two convolutional neural network architectures and two types of generated datasets show that the proposed Data Reduction CNN (DRCNN) approach can produce more accurate results than existing popular data reduction methods, and can be used in a wide range of problem settings. The integration of knowledge about the task allows for more image compression and higher accuracies compared to standard data reduction methods.
Influence of the CO2 Content in Shielding Gas on the Temperature of the Shielding Gas Nozzle during GMAW Welding
Authors: Lohse Martin , Trautmann Marcus , Füssel Uwe , Rose Sascha
Published: December 2020

Gas metal arc welding torches are commonly chosen based on their current-carrying capacity. It is known that the current-carrying capacity of welding torches under CO2 is usually higher than under argon dominated shielding gases. In this publication, the extent to which this can be attributed to the shielding gas dependent arc radiation is investigated. For this purpose, the influence of the shielding gas on the thermal load of the shielding gas nozzle of a GMAW torch was calorimetrically measured. These experiments were carried out for four different shielding gases (argon, CO2, and two argon/CO2 mixtures). The measurements were all performed at an average current of 300 A. The welding current was set by adjusting the wire feed rate or the voltage correction. For each case, a separate set of experiments was done. It is shown that the changed arc radiation resulting from the different shielding gases has an influence on the heat input into the gas nozzle, and thus into the torch. For the same shielding gas, this influence largely correlates with the welding voltage.
Unresolved CFD and DEM Coupled Solver for Particle-Laden Flow and Its Application to Single Particle Settlement
Authors: Song Seongjin , Park Sunho
Published: December 2020

In the present study, a single particle settlement was studied using a developed unresolved computational fluid dynamics (CFD) and discrete element method (DEM) coupling solver. The solver was implemented by coupling OpenFOAM, the open-source computational fluid dynamics libraries, with LIGGGHTS, the open-source discrete element method libraries. An averaging method using a kernel function was considered to decrease the grid dependency. For the drag model of a single particle, a revised volume fraction with a particle volume expansion coefficient was applied. Falling particles in a water tank were simulated and compared with the empirical correlation. A parametric study using several integrated added mass coefficients and volume expansion coefficients from low to high Reynolds numbers was carried out. The simulations which used the developed numerical methods showed significantly improved predictions of particle settlement.
An Inter-Model Comparison for Wave Interactions with Sea Dikes on Shallow Foreshores
Authors: Gruwez Vincent , Altomare Corrado , Suzuki Tomohiro , Streicher Maximilian , Cappietti Lorenzo , Kortenhaus Andreas , Troch Peter
Published: December 2020

Three open source wave models are applied in 2DV to reproduce a large-scale wave flume experiment of bichromatic wave transformations over a steep-sloped dike with a mildly-sloped and very shallow foreshore: (i) the Reynolds-averaged Navier–Stokes equations solver interFoam of OpenFOAM® (OF), (ii) the weakly compressible smoothed particle hydrodynamics model DualSPHysics (DSPH) and (iii) the non-hydrostatic nonlinear shallow water equations model SWASH. An inter-model comparison is performed to determine the (standalone) applicability of the three models for this specific case, which requires the simulation of many processes simultaneously, including wave transformations over the foreshore and wave-structure interactions with the dike, promenade and vertical wall. A qualitative comparison is done based on the time series of the measured quantities along the wave flume, and snapshots of bore interactions on the promenade and impacts on the vertical wall. In addition, model performance and pattern statistics are employed to quantify the model differences. The results show that overall, OF provides the highest model skill, but has the highest computational cost. DSPH is shown to have a reduced model performance, but still comparable to OF and for a lower computational cost. Even though SWASH is a much more simplified model than both OF and DSPH, it is shown to provide very similar results: SWASH exhibits an equal capability to estimate the maximum quasi-static horizontal impact force with the highest computational efficiency, but does have an important model performance decrease compared to OF and DSPH for the force impulse.
Pneumocystis jirovecii Pneumonia in Children with Hematological Malignancies: Diagnosis and Approaches to Management
Authors: Mantadakis Elpis
Published: December 2020

Pneumocystis jirovecii pneumonia (PJP) is an opportunistic infection that mostly affects children with suppressed cellular immunity. PJP was the most common cause of infectious death in children with acute lymphoblastic leukemia prior to the inclusion of cotrimoxazole prophylaxis as part of the standard medical care in the late 1980s. Children with acute leukemia, lymphomas, and those undergoing hematopoietic stem cell transplantation, especially allogeneic transplantation, are also at high risk of PJP. Persistent lymphopenia, graft versus host disease, poor immune reconstitution, and lengthy use of corticosteroids are significant risk factors for PJP. Active infection may be due to reactivation of latent infection or recent acquisition from environmental exposure. Intense hypoxemia and impaired diffusing capacity of the lungs are hallmarks of PJP, while computerized tomography of the lungs is the diagnostic technique of choice. Immunofluorescence testing with monoclonal antibodies followed by fluorescent microscopy and polymerase chain reaction testing of respiratory specimens have emerged as the best diagnostic methods. Measurement of (1-3)-β-D-glucan in the serum has a high negative predictive value in ruling out PJP. Oral cotrimoxazole is effective for prophylaxis, but in intolerant patients, intravenous and aerosolized pentamidine, dapsone, and atovaquone are effective alternatives. Ιntravenous cotrimoxazole is the treatment of choice, but PJP has a high mortality even with appropriate therapy.
Corporate Bond Market in Poland—Prospects for Development
Authors: Kubiczek Jakub
Published: December 2020

The Polish corporate bond market does not have a history as long as the American one, however, it is characterized by stable annual growth. The growth of the market is related to the growth of its liquidity and is determined by a number of entities, both on the demand and the supply side. The aim of the study was to present the structure of the Catalyst market and bond trading in Poland. The study also discusses the market’s development and identifies the factors that determine this development. Based on reports concerning trading on the Catalyst market, a huge growth was noticed in the 10 years since the market’s establishment. Forecasts indicate that the growth will continue. The outbreak of the SARS-CoV-2 pandemic will cause the market development to be slower than the model’s forecast, although the data for the first nine months of 2020 suggest that the upward trend will be maintained. Moreover, for the market to continue to thrive, a rating must be compulsory for corporate bond issuers. A comparison of the ratings of individual issuers enables investors to analyze the risk and profitability of corporate bonds in an easier way.
Certainty and Uncertainty in Tax Law: Do Opposites Attract?
Authors: Demin Alexander V.
Published: December 2020

The principle of certainty of taxation is the dimension of a general requirement of certainty in the legal system. The purpose of this article is to argue the thesis that uncertainty in tax law is not always an absolute evil, sometimes it acts as a means of the most optimal (and in some cases the only possible) settlement of relations in the field of taxes. On the contrary, uncertainty and fragmentation in tax law are colossal problems subject to overcome by the efforts of scientists, legislators, judges, and practicing lawyers. Uncertainty in tax law is manifested in two ways: on the one hand, negatively—as a defect (omission) of the legislator and, on the other hand, positively—as a set of specific legal means and technologies that are purposefully used in lawmaking and law enforcement. In this context, relatively determined legal tools are an effective channel for transition from uncertainty to certainty in the field of taxation. A tendency towards increased use of relatively determined legal tools in lawmaking processes (for example, principles, evaluative concepts, judicial doctrines, standards of good faith and reasonableness, discretion, open-ended lists, recommendations, framework laws, silence of the law, presumptive taxation, analogy, etc.), and involving various actors (courts, law enforcement agencies and officials, international organizations, citizens, organizations and their associations) allow making tax laws more dynamic flexible, and adequate to changing realities of everyday life.
Advances in the Deformation and Failure of Concrete Pavement under Coupling Action of Moisture, Temperature, and Wheel Load
Authors: Dong Wanguo , Liu Chunlin , Bao Xueben , Xiang Tengfei , Chen Depeng
Published: December 2020

The deformation and cracking of concrete will lead to various deterioration processes, which will greatly reduce the durability and service life of the concrete pavement. The relating previous studies and analysis revealed that the coupling action of environmental temperature, moisture, and wheel load will cause cracking and seriously affect the normal service and durability of pavement concrete. This paper presents theoretical and numerical state-of-the-art information in the field of deformation and failure of pavement concrete under coupling action of moisture, temperature, and wheel load and draws some conclusions. (a) Concrete is a typical porous material, moisture and heat transfer theory has obtained enough data to simulate the hygro-thermo properties of concrete, and the relationship between moisture and heat is very clear. (b) There are few studies on concrete pavement or airport pavement considering the coupling action of moisture, temperature, and wheel load. (c) Concrete pavement is subjected to hygro-thermal-mechanical coupling action in service, which has the characteristics of a similar period and its possible fatigue effect. (d) COMSOL software has certain advantages for solving the coupled hygro-thermal-mechanical of concrete.
Extension of Solid Solubility and Structural Evolution in Nano-Structured Cu-Cr Solid Solution Induced by High-Energy Milling
Authors: Shan Liyuan , Wang Xueliang , Wang Yaping
Published: December 2020

In Cu-Cr alloys, the strengthening effects of Cr are severely limited due to the relatively low Cr solid solubility in Cu matrix. In addition, apart from the dissolved Cr, it should be noted that high proportion of Cr in Cu matrix work as the second phase dispersion strengthening. Therefore, it is of great significance to extend the Cr solid solubility and decrease the size of the undissolved Cr phase to nano-structure. In this work, the nano-sized Cu-5 wt.% Cr solid solution was achieved through high energy ball milling (HEBM) only for 12 h. The Cr solubility of ~1.15 at.% was quantitatively calculated based on XRD patterns, which means supersaturated solid solution was realized. Except for the dissolved Cr, the undissolved Cr phase was with nano-sized work as the second phase. Upon milling of the Cu-Cr powders with coarse grains, the crystallite sizes and grain sizes are found to decrease with the milling time, and remain almost unchanged at a steady-state with continued milling. In addition, it was found that the stored energy induced by dislocation density increment and grain size refinement would be high enough to overcome the thermodynamic barrier for the formation of solid solution.
316L Stainless Steel Powders for Additive Manufacturing: Relationships of Powder Rheology, Size, Size Distribution to Part Properties
Authors: Groarke Robert , Danilenkoff Cyril , Karam Sara , McCarthy Eanna , Michel Bastien , Mussatto Andre , Sloane John , O’ Neill Aidan , Raghavendra Ramesh , Brabazon Dermot
Published: December 2020

Laser-Powder Bed Fusion (L-PBF) of metallic parts is a highly multivariate process. An understanding of powder feedstock properties is critical to ensure part quality. In this paper, a detailed examination of two commercial stainless steel 316L powders produced using the gas atomization process is presented. In particular, the effects of the powder properties (particle size and shape) on the powder rheology were examined. The results presented suggest that the powder properties strongly influence the powder rheology and are important factors in the selection of suitable powder for use in an additive manufacturing (AM) process. Both of the powders exhibited a strong correlation between the particle size and shape parameters and the powder rheology. Optical microscope images of melt pools of parts printed using the powders in an L-PBF machine are presented, which demonstrated further the significance of the powder morphology parameters on resulting part microstructures.
Characterization of a Sandwich PLGA-Gallic Acid-PLGA Coating on Mg Alloy ZK60 for Bioresorbable Coronary Artery Stents
Authors: Lin Li-Han , Lee Hung-Pang , Yeh Ming-Long
Published: December 2020

Absorbable magnesium stents have become alternatives for treating restenosis owing to their better mechanical properties than those of bioabsorbable polymer stents. However, without modification, magnesium alloys cannot provide the proper degradation rate required to match the vascular reform speed. Gallic acid is a phenolic acid with attractive biological functions, including anti-inflammation, promotion of endothelial cell proliferation, and inhibition of smooth muscle cell growth. Thus, in the present work, a small-molecule eluting coating is designed using a sandwich-like configuration with a gallic acid layer enclosed between poly (d,l-lactide-co-glycolide) layers. This coating was deposited on ZK60 substrate, a magnesium alloy that is used to fabricate bioresorbable coronary artery stents. Electrochemical analysis showed that the corrosion rate of the specimen was ~2000 times lower than that of the bare counterpart. The released gallic acid molecules from sandwich coating inhibit oxidation by capturing free radicals, selectively promote the proliferation of endothelial cells, and inhibit smooth muscle cell growth. In a cell migration assay, sandwich coating delayed wound closure in smooth muscle cells. The sandwich coating not only improved the corrosion resistance but also promoted endothelialization, and it thus has great potential for the development of functional vascular stents that prevent late-stent restenosis.
Behavior Deterioration and Microstructure Change of Polyvinyl Alcohol Fiber-Reinforced Cementitious Composite (PVA-ECC) after Exposure to Elevated Temperatures
Authors: Wang Qing , Yao Boyu , Lu Runze
Published: December 2020

In the case of fire, explosive spalling often occurs in cementitious composites due to dense microstructure and high pore-pressure. Polymer fibers were proved to be effective in mitigating such behavior. However, deterioration of these fiber-reinforced cementitious composites inevitably occurs, which is vital for the prediction of structural performance and prevention of catastrophic disaster. This paper concentrates on the behavior and mechanism of the deterioration of polyvinyl alcohol fiber-reinforced engineered cementitious composite (PVA-ECC) after exposure to elevated temperatures. Surface change, cracking, and spalling behavior of the cubic specimens were observed at room temperature, and after exposure to 200 °C, 400 °C, 600 °C, 800 °C, and 1200 °C. Losses in specimen weight and compressive strength were evaluated. Test results indicated that explosive spalling behavior was effectively prevented with 2.0 vol% polyvinyl alcohol fiber although the strength monotonically decreased with heating temperature. X-ray diffraction curves showed that the calcium hydroxide initially decomposed in the range of 400–600 °C, and finished beyond 600 °C, while calcium silicate hydrate began at around 400 °C and completely decomposed at approximately 800 °C. Micrographs implied a reduction in fiber diameter at 200 °C, exhibiting apparent needle-like channels beyond 400 °C. When the temperature was increased to 600 °C and above, the dents were gradually filled with newly produced substance due to the synergistic effect of thermal expansion, volume expansion of chemical reactions, and pore structure coarsening
A New Preparation Method of Cement with Photocatalytic Activity
Authors: Janus Magdalena , Mądraszewski Szymon , Zając Kamila , Kusiak-Nejman Ewelina
Published: December 2020

The studies of some mechanical properties and photocatalytic activity of new cements with photocatalytic activity are presented. The new building materials were obtained by addition of semi-product from titanium white production. Semi-product was calcined at 300 and 600 °C for one, three, and five hours and then this material was added to cement matrix in an amount of 1 and 3 wt.%. New materials were characterized by measuring the flexural and compressive strength and the initial and the final setting time. The photocatalytic activity was tested during NOx photooxidation. The cement with photocatalytic activity was also characterized by sulphur content measurements. The measurement of reflectance percentage of TiO2-loaded cements in comparison with pristine cement and TiO2 photocatalyst calcined at 600 °C were also performed. It should be emphasized that although in some cases, the addition of photocatalyst reduced the flexural and the compressive strength of the modified cements, these values were still within the norm PN-EN 197-1:2012. It was also found that the initial and the final setting time is connected with the crystal size of anatase, and the presence of larger crystals significantly delays of the setting time. This was probably caused by a water adsorption on the surface of anatase crystals.
Revisiting Classical Issues of Fatigue Crack Growth Using a Non-Linear Approach
Authors: Borges Micael F. , Neto Diogo M. , Antunes Fernando V.
Published: December 2020

Fatigue crack growth (FCG) has been studied for decades; however, several aspects are still objects of controversy. The objective here is to discuss different issues, using a numerical approach based on crack tip plastic strain, assuming that FCG is driven by crack tip deformation. ΔK was found to control cyclic plastic deformation at the crack tip, while Kmax has no effect. Therefore, alternative mechanisms are required to justify models based on ΔK and Kmax. The analysis of crack tip plastic deformation also showed that there is crack tip damage below crack closure. Therefore, the definition of an effective load range ΔKeff = Kmax − Kopen is not correct, because the portion of load range below opening also contributes to FCG. Below crack closure, damage occurs during unloading while during loading the crack tip deformation is elastic. However, if the maximum load is decreased below the elastic limit, which corresponds to the transition between elastic and elasto–plastic regimes, there is no crack tip damage. Additionally, a significant effect of the crack ligament on crack closure was found in tests with different crack lengths and the same ΔK. Finally, the analysis of FCG after an overload with and without contact of crack flanks showed that the typical variation of da/dN observed is linked to crack closure variations, while the residual stresses ahead of crack tip are not affected by the contact of crack flanks.
Effects of a Novel NiTi Thermomechanical Treatment on the Geometric Features of the Prepared Root Canal System
Authors: Alghamdi Abdulwahed , Alsofi Loai , Balto Khaled
Published: December 2020

Objectives: This study aimed to compare the ex vivo performance of two rotary nickel–titanium (NiTi) systems with similar designs but manufactured from martensitic and austenitic alloys, the One Curve (OC) and One Shape (OS) rotary endodontic files, respectively. Methods: Forty separate mesial canals of 20 extracted mandibular molars were scanned using micro-computed tomography (CT), which were divided into 2 groups and instrumented with OC and OS, respectively. Post-instrumentation micro-CT scans were evaluated using validated computer algorithms to compare changes in canal thickness, surface area, structure model index (SMI) scores, volume of removed dentin, percentage of untreated canal surface, percentage of curvature straightening, and the amount of canal transportation. Results: Both files led to significant changes in the basic root canal geometry, with no preparation errors and no statistically significant differences. However, OC treatment resulted in significantly less curvature straightening (17.30%; 10.77%) (independent samples t test, p < 0.05) and less apical transportation (55.11 µm; 33.15 µm) (Mann–Whitney U, test p < 0.05) compared to OS treatment. Transportation values in the middle and coronal thirds were statistically similar (independent sample t-test, p > 0.05). OC treatment produced significantly less straightening and less apical transportation than OS.
Mathematics Teachers’ Perceptions of the Introduction of ICT: The Relationship between Motivation and Use in the Teaching Function
Authors: Trujillo-Torres Juan-Manuel , Hossein-Mohand Hossein , Gómez-García Melchor , Hossein-Mohand Hassan , Cáceres-Reche María-Pilar
Published: December 2020

Digital self-efficacy and the amount of perceived support from the school can improve teachers’ motivation to increase the use of information and communication technology (ICT) in the classroom. Likewise, attitude, perception, gender, and experience of mathematics teachers are factors that influence their use of ICT. This study aimed to analyze the profiles of mathematics teachers, determine the existence of differences between them, and identify the sample size necessary to detect significant differences. A total of 73 high school teachers were included in this cross-sectional study. Teaching practice, ICT resources, ICT in the classroom, skills, and uses of ICT were assessed through a validated 19-item questionnaire. Statistical analysis revealed that the required sample to detect significant differences was 53 subjects. Further, 67.21% of the mathematics teachers surveyed in Melilla were younger than 40 years of age, and 62.30% had less than 6 years of teaching experience. In addition, 81.97 and 47.54% of mathematics teachers stated that they consider themselves to have sufficient ICT resources at home for their work and in the classroom, respectively. Through different clusters, mathematics teachers can be identified and classified according to their motivational and competence profiles in pedagogical and digital areas. In addition, young teachers with some teaching experience had positive perceptions of technology, as reflected by high scores in the motivation indicator for ICT.
Extraction and Characterization of Collagen from Elasmobranch Byproducts for Potential Biomaterial Use
Authors: Seixas Manuel J. , Martins Eva , Reis Rui L. , Silva Tiago H.
Published: December 2020

With the worldwide increase of fisheries, fish wastes have had a similar increase, alternatively they can be seen as a source of novel substances for the improvement of society’s wellbeing. Elasmobranchs are a subclass fished in high amounts, with some species being mainly bycatch. They possess an endoskeleton composed mainly by cartilage, from which chondroitin sulfate is currently obtained. Their use as a viable source for extraction of type II collagen has been hypothesized with the envisaging of a biomedical application, namely in biomaterials production. In the present work, raw cartilage from shark (Prionace glauca) and ray (Zeachara chilensis and Bathyraja brachyurops) was obtained from a fish processing company and submitted to acidic and enzymatic extractions, to produce acid-soluble collagen (ASC) and pepsin-soluble collagen (PSC). From all the extractions, P. glauca PSC had the highest yield (3.5%), followed by ray ASC (0.92%), ray PSC (0.50%), and P. glauca ASC (0.15%). All the extracts showed similar properties, with the SDS-PAGE profiles being compatible with the presence of both type I and type II collagens. Moreover, the collagen extracts exhibited the competence to maintain their conformation at human basal temperature, presenting a denaturation temperature higher than 37 °C. Hydrogels were produced using P. glauca PSC combined with shark chondroitin sulfate, with the objective of mimicking the human cartilage extracellular matrix. These hydrogels were cohesive and structurally-stable at 37 °C, with rheological measurements exhibiting a conformation of an elastic solid when submitted to shear strain with a frequency up to 4 Hz. This work revealed a sustainable strategy for the valorization of fisheries’ by-products, within the concept of a circular economy, consisting of the use of P. glauca, Z. chilensis, and B. brachyurops cartilage for the extraction of collagen, which would be further employed in the development of hydrogels as a proof of concept of its biotechnological potential, ultimately envisaging its use in marine biomaterials to regenerate damaged cartilaginous tissues.
Metabolic Signatures of Gestational Weight Gain and Postpartum Weight Loss in a Lifestyle Intervention Study of Overweight and Obese Women
Authors: Lau Chung-Ho E. , Taylor-Bateman Victoria , Vorkas Panagiotis A. , Graça Gonçalo , Vu Thanh-Huyen T. , Hou Lifang , Chekmeneva Elena , Ebbels Timothy M. D. , Chan Queenie , Van Horn Linda , Holmes Elaine
Published: December 2020

Background: Overweight and obesity amongst women of reproductive age are increasingly common in developed economies and are shown to adversely affect birth outcomes and both childhood and adulthood health risks in the offspring. Metabolic profiling in conditions of overweight and obesity in pregnancy could potentially be applied to elucidate the molecular basis of the adverse effects of gestational weight gain (GWG) and postpartum weight loss (WL) on future risks for cardiovascular disease (CVD) and other chronic diseases. Methods: Biofluid samples were collected from 114 ethnically diverse pregnant women with body mass index (BMI) between 25 and 40 kg/m2 from Chicago (US), as part of a randomized lifestyle intervention trial (Maternal Offspring Metabolics: Family Intervention Trial; NCT01631747). At 15 weeks, 35 weeks of gestation, and at 1 year postpartum, the blood plasma lipidome and metabolic profile of urine samples were analyzed by liquid chromatography mass spectrometry (LC-MS) and 1H nuclear magnetic resonance spectroscopy (1H NMR) respectively. Results: Urinary 4-deoxyerythronic acid and 4-deoxythreonic acid were found to be positively correlated to BMI. Seventeen plasma lipids were found to be associated with GWG and 16 lipids were found to be associated with WL, which included phosphatidylinositols (PI), phosphatidylcholines (PC), lysophospholipids (lyso-), sphingomyelins (SM) and ether phosphatidylcholine (PC-O). Three phospholipids found to be positively associated with GWG all contained palmitate side-chains, and amongst the 14 lipids that were negatively associated with GWG, seven were PC-O. Six of eight lipids found to be negatively associated with WL contained an 18:2 fatty acid side-chain. Conclusions: Maternal obesity was associated with characteristic urine and plasma metabolic phenotypes, and phospholipid profile was found to be associated with both GWG and postpartum WL in metabolically healthy pregnant women with overweight/obesity. Postpartum WL may be linked to the reduction in the intake of linoleic acid/conjugated linoleic acid food sources in our study population.
Electromechanical Analysis of Flexoelectric Nanosensors Based on Nonlocal Elasticity Theory
Authors: Su Yaxuan , Zhou Zhidong
Published: December 2020

Flexoelectric materials have played an increasingly vital role in nanoscale sensors, actuators, and energy harvesters due to their scaling effects. In this paper, the nonlocal effects on flexoelectric nanosensors are considered in order to investigate the coupling responses of beam structures. This nonlocal elasticity theory involves the nonlocal stress, which captures the effects of nonlocal and long-range interactions, as well as the strain gradient stress. Based on the electric Gibbs free energy, the governing equations and related boundary conditions are deduced via the generalized variational principle for flexoelectric nanobeams subjected to several typical external loads. The closed-form expressions of the deflection and induced electric potential (voltage) values of flexoelectric sensors are obtained. The numerical results show that the nonlocal effects have a considerable influence on the induced electric potential of flexoelectric sensors subjected to general transverse forces. Moreover, the induced electric potential values of flexoelectric sensors calculated by the nonlocal model may be smaller or larger than those calculated by the classical model, depending on the category of applied loads. The present research indicates that nonlocal effects should be considered in order to understand or design basic nano-electromechanical components subjected to various external loads.
Portable Device for Quick Detection of Viable Bacteria in Water
Authors: Liao Yu-Hsiang , Muthuramalingam Karthickraj , Tung Kuo-Hao , Chuan Ho-Hsien , Liang Ko-Yuan , Hsu Chen-Peng , Cheng Chao-Min
Published: December 2020

(1) Background: Access to clean water is a very important factor for human life. However, pathogenic microorganisms in drinking water often cause diseases, and convenient/inexpensive testing methods are urgently needed. (2) Methods: The reagent contains 3-(4,5-dimethylthiazol-2-yl)-2,5-diphenyltetrazolium bromide (MTT) and phenazine methosulfate (PMS) and can react with succinate dehydrogenase within bacterial cell membranes to produce visible purple crystals. The colorimetric change of the reagent after reaction can be measured by a sensor (AS7262). (3) Results: Compared with traditional methods, our device is simple to operate and can provide rapid (i.e., 5 min) semi-quantitative results regarding the concentration of bacteria within a test sample. (4) Conclusions: This easy-to-use device, which employs MTT-PMS reagents, can be regarded as a potential and portable tool for rapid water quality determination.
Impact of Inoculum Type on the Microbial Community and Power Performance of Urine-Fed Microbial Fuel Cells
Authors: Salar-Garcia Maria Jose , Obata Oluwatosin , Kurt Halil , Chandran Kartik , Greenman John , Ieropoulos Ioannis A.
Published: December 2020

Bacteria are the driving force of the microbial fuel cell (MFC) technology, which benefits from their natural ability to degrade organic matter and generate electricity. The development of an efficient anodic biofilm has a significant impact on the power performance of this technology so it is essential to understand the effects of the inoculum nature on the anodic bacterial diversity and establish its relationship with the power performance of the system. Thus, this work aims at analysing the impact of 3 different types of inoculum: (i) stored urine, (ii) sludge and (iii) effluent from a working MFC, on the microbial community of the anodic biofilm and therefore on the power performance of urine-fed ceramic MFCs. The results showed that MFCs inoculated with sludge outperformed the rest and reached a maximum power output of 40.38 mW·m−2anode (1.21 mW). The power performance of these systems increased over time whereas the power output by MFCs inoculated either with stored urine or effluent decreased after day 30. These results are directly related to the establishment and adaptation of the microbial community on the anode during the assay. Results showed the direct relationship between the bacterial community composition, originating from the different inocula, and power generation within the MFCs.
Strategies to Improve the Thermo-Oxidative Stability of Sunflower Oil by Exploiting the Antioxidant Potential of Blueberries Processing Byproducts
Authors: Metzner Ungureanu Cristina-Ramona , Poiana Mariana-Atena , Cocan Ileana , Lupitu Andreea Ioana , Alexa Ersilia , Moigradean Diana
Published: December 2020

This research was conducted in order to establish the effectiveness of two freeze-dried extracts obtained from blueberry processing byproducts resulting from juice manufacturing compared to butylated hydroxytoluene (BHT) in delaying the lipid oxidation of sunflower oil subjected to high-temperature convective heating at 180 °C up to 12 h under simulated frying conditions. The fruits were harvested from spontaneous flora of two regions of Romania, Arieseni (Alba County) and Paltinis (Sibiu County) and the blueberry byproducts extracts (BBE) were noted according to the origin place as ABBE and PBBE. The progress of lipid thermo-oxidation was investigated in terms of peroxide value (PV), p-anisidine value (p-AV), the response of TBA-malondialdehyde interactions assessed by thiobarbituric acid (TBA) method, the total oxidation (TOTOX) value and inhibition of oil oxidation (IO). The recorded data highlighted that BBE exhibit a high inhibitory response on lipid thermo-oxidation. The inhibitory effect was concentration-dependent, thus, the degree of lipid oxidation was in reverse related to the BBE dose. The exposure of the oil samples supplemented with 800 ppm BBE (ABBE, PBBE) to a high-temperature heating for 12 h led to a significant decrease of the assessed indices compared to additives-free sunflower oil sample as follows: PV (46%; 45%), p-AV (21%; 17%), TOTOX (27%; 24%), TBA value (25%; 11%). Regarding the impact of the origin on the potential of BBE to inhibit the lipid oxidative degradation, it was noted that ABBE derived from blueberries grown in a region with a milder climate with moderate precipitations and higher temperatures showed a stronger inhibitory effect on lipid thermo-oxidation than PBBE. A moderate level of 500 ppm BBE inhibited the lipid oxidation similar to 200 ppm BHT. The reported results reveal that BBE represent efficient natural antioxidants that could be successfully applied to improve the thermo-oxidative stability of sunflower oil used in various high-temperature food applications.
Targeting the RdRp of Emerging RNA Viruses: The Structure-Based Drug Design Challenge
Authors: Picarazzi Francesca , Vicenti Ilaria , Saladini Francesco , Zazzi Maurizio , Mori Mattia
Published: December 2020

The RNA-dependent RNA polymerase (RdRp) is an essential enzyme for the viral replication process, catalyzing the viral RNA synthesis using a metal ion-dependent mechanism. In recent years, RdRp has emerged as an optimal target for the development of antiviral drugs, as demonstrated by recent approvals of sofosbuvir and remdesivir against Hepatitis C virus (HCV) and severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2), respectively. In this work, we overview the main sequence and structural features of the RdRp of emerging RNA viruses such as Coronaviruses, Flaviviruses, and HCV, as well as inhibition strategies implemented so far. While analyzing the structural information available on the RdRp of emerging RNA viruses, we provide examples of success stories such as for HCV and SARS-CoV-2. In contrast, Flaviviruses’ story has raised attention about how the lack of structural details on catalytically-competent or ligand-bound RdRp strongly hampers the application of structure-based drug design, either in repurposing and conventional approaches.
Determination of Ascorbic Acid, Total Ascorbic Acid, and Dehydroascorbic Acid in Bee Pollen Using Hydrophilic Interaction Liquid Chromatography-Ultraviolet Detection
Authors: Zhu Meifei , Tang Jian , Tu Xijuan , Chen Wenbin
Published: December 2020

Ascorbic acid (AA) is one of the essential nutrients in bee pollen, however, it is unstable and likely to be oxidized. Generally, the oxidation form (dehydroascorbic acid (DHA)) is considered to have equivalent biological activity as the reduction form. Thus, determination of the total content of AA and DHA would be more accurate for the nutritional analysis of bee pollen. Here we present a simple, sensitive, and reliable method for the determination of AA, total ascorbic acids (TAA), and DHA in rape (Brassica campestris), lotus (Nelumbo nucifera), and camellia (Camellia japonica) bee pollen, which is based on ultrasonic extraction in metaphosphoric acid solution, and analysis using hydrophilic interaction liquid chromatography (HILIC)-ultraviolet detection. Analytical performance of the method was evaluated and validated, then the proposed method was successfully applied in twenty-one bee pollen samples. Results indicated that contents of AA were in the range of 17.54 to 94.01 µg/g, 66.01 to 111.66 µg/g, and 90.04 to 313.02 µg/g for rape, lotus, and camellia bee pollen, respectively. In addition, percentages of DHA in TAA showed good intra-species consistency, with values of 13.7%, 16.5%, and 7.6% in rape, lotus, and camellia bee pollen, respectively. This is the first report on the discriminative determination between AA and DHA in bee pollen matrices. The proposed method would be valuable for the nutritional analysis of bee pollen.