bluuebunny/crossref_metadata_2025 huggingface dataset:
Comparison of Antimycotic Activity of Originator and Generics of Voriconazole and Anidulafungin against Clinical Isolates of Candida albicans and Candida glabrata
Authors: Nussbaumer-Pröll Alina Karoline , Eberl Sabine , Welte René , Gasperetti Tiziana , Marx Jana , Bellmann Romuald , Zeitlinger Markus
Published: February 2022

Background: Concerns have been expressed about the interchangeability of innovator and generic antifungals in their activity and chemical stability. Materials/methods: The activity of two different antimycotics was tested, each with one originator and two generics. For voriconazole, the originator VFEND® (Pfizer) and the generics (Ratiopharm and Stada) were used for susceptibility testing (21 clinical isolates of Candida albicans (C. albicans); ATCC-90028 C. albicans) in RPMI growth media in compliance with the EUCAST criteria. Likewise, for anidulafungin, the originator ECALTA® (Pfizer) and the generics (Stada and Pharmore) were used for testing (20 clinical isolates of Candida glabrata (C. glabrata); ATCC-22019 Candida parapsilosis (C. parapsilosis)). Time Kill Curves (TKC) with concentrations above and below the respective MIC were performed for one strain for each antifungal. Stability testing of the antimycotics stored at 4 °C and at room temperature over 24 h was done, and samples were subsequently analyzed with HPLC. Results: MIC results showed no significant difference in activity of generic and innovator antimycotic in all settings, which was also confirmed by TKC. Stability testing revealed no differences between originator and generic drugs. Conclusions: The present study demonstrates the interchangeability of generic and originator antimycotic in-vitro, potentially leading to broader public acceptance for generic antimycotics.
Valley Hall Elastic Edge States in Locally Resonant Metamaterials
Authors: Fang Wenbo , Han Chunyu , Chen Yuyang , Liu Yijie
Published: February 2022

This paper presents a locally resonant metamaterial periodically rearranged as a local resonator, that is hexagonal holes arranged in a thin plate replace the elastic local resonator to achieve the quantum valley Hall effect. Due to the C3v symmetry in the primitive hexagonal lattice, one Dirac point emerges at high symmetry points in the Brillouin zone in the sub-wavelength area. Rotating the beam element of the resonator can break the spatial inversion symmetry to lift the Dirac degeneracy and form a new bandgap. Thus, the band inversion is discovered by computing the relationship between the associated bandgap and the rotational parameter. We also confirmed this result by analyzing the vortex chirality and calculating the Chern number. We can discover two kinds of edge states in the projected band obtained by computing the supercell composed of different topological microstructures. Finally, the propagation behavior in various heterostructures at low frequencies was analyzed. It is shown that these valley Hall elastic insulators can guide elastic waves along sharp interfaces and are immune to backscattering from defects or disorder. By utilizing elastic resonators, a simple reconfigurable topological elastic metamaterial is realized in the sub-wavelength area.
Biochar from Wood Chips and Corn Cobs for Adsorption of Thioflavin T and Erythrosine B
Authors: Pipíška Martin , Krajčíková Eva Klára , Hvostik Milan , Frišták Vladimír , Ďuriška Libor , Černičková Ivona , Kaňuchová Mária , Conte Pellegrino , Soja Gerhard
Published: February 2022

Biochars from wood chips (WC) and corn cobs (CC) were prepared by slow pyrolysis and used for sorption separation of erythrosine B (EB) and thioflavin T (TT) in batch experiments. Biochar-based adsorbents were extensively characterized using FTIR, XRD, SEM-EDX, and XPS techniques. The kinetics studies revealed that adsorption on external surfaces was the rate-limiting step for the removal of TT on both WC and CC biochar, while intraparticle diffusion was the rate-limiting step for the adsorption of EB. Maximal experimental adsorption capacities Qmaxexp of TT reached 182 ± 5 (WC) and 45 ± 2 mg g−1 (CC), and EB 12.7 ± 0.9 (WC) and 1.5 ± 0.4 mg g−1 (CC), respectively, thereby indicating a higher affinity of biochars for TT. The adsorption mechanism was found to be associated with π-π interaction, hydrogen bonding, and pore filling. Application of the innovative dynamic approach based on fast-field-cycling NMR relaxometry indicates that variations in the retention of water-soluble dyes could be explained by distinct water dynamics in the porous structures of WC and CC. The obtained results suggest that studied biochars will be more effective in adsorbing of cationic than anionic dyes from contaminated effluents.
Strengthening of CoNiFeV0.5Mo0.2 Medium Entropy Alloy Wire Rods with Loading-Unloading Cycles
Authors: An Xulong , Chu Chenglin , Sun Wenwen , Wei Wei
Published: February 2022

Changes in the texture as well as mechanical properties of CoNiFeV0.5Mo0.2 medium entropy alloy wire rods during loading–unloading are investigated. The intensity of the recrystallization texture {001}<110> component and fraction of low angle grains increase with the loading–unloading cycles and the alloy strength increases (934 MPa to 1083 MPa) due to dislocation increment in the loading–unloading cycles. The loading modulus (El) and average modulus (Esecant) for a hysteresis loop decrease slightly, whereas the unloading modulus (Eun) increases, the Eun increment of 5-TC-UTand 10-TC-UT are 22 and 137 GPa.
Analytical and Numerical Approaches for the Design of Concrete Structural Elements with Internal BFRP Reinforcement
Authors: Zhelyazov Todor , Thorhallsson Eythor
Published: February 2022

Although basalt fiber-reinforced polymers (BFRPs) have been known for a few decades, new trends such as sustainability and environmental care have provoked intensified research on its structural applications. In construction, BFRPs, as internal reinforcement, have to compete with traditional steel reinforcement products. Because of their high resistance to aggressive environments, BFRPs have emerged as an attractive solution for the infrastructure in coastal zones. In this article, we discuss some aspects of BFRP applications such as flexural reinforcement of concrete beams. The mechanical performances of a BFRP-reinforced beam are illustrated by using a widely accepted model based on the classical beam theory. The elasticity modulus of the BFRP reinforcement is lower than that of structural steel. Therefore, to meet serviceability requirements (e.g., in terms of limitation on the mid-span deflection of a beam), BFRP could be pre-tensioned. The positive effect of pre-tensioning is outlined by finite element analysis. An original numerical procedure involves a constitutive relation for concrete based on damage mechanics. Experimental results previously reported in the literature provide the background for the numerical model procedures. The numerical procedure predicts the mechanical response of the concrete beam with BFRP reinforcement subjected to four-point bending in terms of load-deflection relationship and dominant failure mode.
Potential for Use of Recycled Cathode Ray Tube Glass in Making Concrete Blocks and Paving Flags
Authors: Grdić Dušan , Despotović Iva , Ristić Nenad , Grdić Zoran , Ćurčić Gordana Topličić
Published: February 2022

The potential to use waste glass, including cathode ray tube (CRT) glass, for making new products or as an admixture to existing ones is being intensively investigated. This kind of research intensified particularly in the period after CRT TV sets and computer monitors were replaced in the market by the advanced technology of thin film transistor (TFT) and liquid crystal display (LCD) screens. Cathode ray tube glass represents a considerable part of electronic waste (e-waste). E-waste globally increases at a far higher rate than other solid waste materials. There is a possibility to recycle cathode ray tube glass and use it in the construction industry. This paper shows the test results of physical and mechanical properties of blocks and paving flags. The reference specimen was made with quartz sand, while the other product employed a combination of quartz sand and ground panel cathode ray tube glass. The glass was ground to the fraction 0.25/1.00 mm, which corresponds to quartz sand fineness. The following tests were performed: shape and dimensions, resistance to freeze/thaw and de-icing salts, water absorption, splitting tensile strength and tensile strength by bending. Special attention was paid to the tests of Böhme wear resistance, slip resistance of the top surface of CRT products using a pendulum, radioactivity and leaching. The texture of the experimental concrete products was observed by SEM (scanning electron microscopy) and analyzed. The results obtained by experimental testing unequivocally show that CRT glass can successfully be used for making concrete blocks and paving flags.
Characterisation and Comparison of Material Parameters of 3D-Printable Absorbing Materials
Authors: Plüss Tobias , Zimmer Felix , Hehn Tobias , Murk Axel
Published: February 2022

We compared different commercially available materials that are 3D-printable for their suitability for making microwave absorbers by means of additive manufacturing, i.e., 3D printing. For this, we determined their complex permittivity, and, if applicable, the complex permeability. They are responsible for the RF losses within the material and, therefore, determine its usefulness as an absorber material. Further, we made SEM (scanning electron microscope) images of material samples showing the filling materials that have been used to achieve absorbing properties.
Investigation of Temperature-Dependent Magnetic Properties and Coefficient of Thermal Expansion in Invar Alloys
Authors: Huang Lin , Zhou Yongjian , Guo Tingwen , Han Dong , Gu Yu , Song Cheng , Pan Feng
Published: February 2022

Invar Fe–Ni alloy is a prominent Ni steel alloy with a low coefficient of thermal expansion around room temperature. We investigate the correlation between magnetic properties and thermal expansion in cold-drawn Fe–36Ni wires with different heat treatment conditions, where the annealing parameters with furnace cooling (cooling from the annealing temperature of 300, 400, 500, 600, 700, 800, 900, and 1000 °C) are used. The variation trend of magnetic properties is consistent with that of thermal expansion for all samples, where the maximum appears at 600 °C -treated sample and 400 °C shows the minimum. The domain size and the area of domain walls determine the total energy of the domain wall, and the total energy directly determines the size of magnetostriction, which is closely related to the coefficient of thermal expansion. Also, the differential thermal analysis (DTA) shows endothermic and exothermic reactions represent crystalline transitions, which could possibly cause the abrupt change of magnetic properties and thermal expansion coefficient of materials. The results indicate that there is a certain relation between thermal expansion and magnetic properties. Besides the fundamental significance, our work provides an Invar alloy with a low coefficient of thermal expansion for practical use.
A Fast Thermal 1D Model to Study Aerospace Material Response Behaviors in Uncontrolled Atmospheric Entries
Authors: Pirrone Serena R. M. , Agabiti Camilla , Pagan Adam S. , Herdrich Georg
Published: February 2022

A preliminary thermal 1D numerical model for studying the demise behavior of stainless steel 316L, silicon carbide (SiC) and carbon fiber reinforced polymer (CFRP) during uncontrolled atmospheric entry is proposed. Test case modeling results are compared to experimental data obtained in the framework of ESA Clean Space initiative: material samples were exposed to different heat flux conditions using the Plasma Wind Tunnel (PWT) facilities at the Institute of Space Systems (IRS) of the University of Stuttgart. This numerical model approximates the heating history of the selected materials by simulating their thermal response and temperature profiles, which have trends similar to the experimental curves that are found. Moreover, when high heat flux conditions are considered, the model simulates the materials’ mass loss due to the ablation process: at the end of the simulation, the difference between the experimental and the modeled results is about 17% for CFRP and 35% for stainless steel. To reduce the model’s uncertainties, the following analysis suggests the need to consider the influence of adequate material thermophysical properties and the physical-chemical processes that affect the samples’ temperature profile and mass loss.
Fixed Abrasive Polishing in an Anhydrous Environment: A Material Removal Model for Fused Silica
Authors: Qian Yuan , Yang Wei , Chen Chaoxu , Yu Xiaoluo
Published: February 2022

Due to the prevalent randomness and uncertainties associated with traditional loose polishing, fixed abrasive polishing in an anhydrous environment has been chosen as a new polishing method. In this paper, cerium oxide is the main component for polishing pellets, and the particle size distribution of cerium oxide is measured. A material removal model for fixed abrasive polishing of fused silica in an anhydrous environment is proposed. Based on this model, we simulate the roughness of fused silica in fixed abrasive polishing process by using a Monte Carlo method with a constant removal mechanism and obtain the percentage of plastic and chemical removal. The percentage result is then taken into the material removal equation to calculate the material removal rate. The final convergence value of the roughness with 2 μm particle size is about 1.8 nm, while the final convergence value of the surface roughness of the workpiece by Monte Carlo simulation is about 1 nm. The experimental material removal rate at 2 μm particle size is 5.48 μm/h, while the simulation result is 4.29 μm/h. The experiment data of roughness and material removal rate all verify the model.
Convergence and the Matthew Effect in the European Union Based on the DESI Index
Authors: Kovács Tünde Zita , Bittner Beáta , Huzsvai László , Nábrádi András
Published: February 2022

The European Commission (EC) has monitored Member States' digital progress through the Digital Economy and Society Index (DESI) since 2014. The DESI index currently ranks the EU Member States and monitors their progress based on four core and 33 individual indicators. We sought to determine whether convergence between the Member States could be detected using the DESI’s annual databases. By examining the variation in the indices, we propose the existence of a so-called “Matthew effect”, i.e., the “rich get richer” syndrome among the 27 EU Member States. We also hypothesised that the COVID-19 pandemic would influence the change in the DESI. Issues investigated were those using bibliometric, statistical-mathematical methods. The σ-convergence analysis was used to estimate the reduction over time of the differences between the Member States, while the β-convergence analysis was used to estimate the rate of catching up with the initial level of development. A PCA analysis was performed to verify the Mathew effect with additional λ-variances considering real GDP per capita change. The σ-convergence was confirmed over the period 2016–2021. The β-convergence was significantly confirmed, and the research also revealed that the half-life of catching up is approximately 20 years. The suggestion of a Matthew effect in the 2016–2021 period, although not significantly confirmed, tends to suggest its existence. The COVID-19 pandemic’s impact on the value of the DESI index is likely to be affected, but future studies are needed to find support for this hypothesis. The study concludes that convergence between the EU-27 Member States can be detected based on the DESI, but this does not imply convergence for all four core DESI indicators.
On the Periodic Solutions for the Perturbed Spatial Quantized Hill Problem
Authors: Abouelmagd Elbaz I. , Alhowaity Sawsan , Diab Zouhair , Guirao Juan L. G. , Shehata Mahmoud H.
Published: February 2022

In this work, we investigated the differences and similarities among some perturbation approaches, such as the classical perturbation theory, Poincaré–Lindstedt technique, multiple scales method, the KB averaging method, and averaging theory. The necessary conditions to construct the periodic solutions for the spatial quantized Hill problem—in this context, the periodic solutions emerging from the equilibrium points for the spatial Hill problem—were evaluated by using the averaging theory, under the perturbation effect of quantum corrections. This model can be used to develop a Lunar theory and the families of periodic orbits in the frame work for the spatial quantized Hill problem. Thereby, these applications serve to reinforce the obtained results on these periodic solutions and gain its own significance.
FORT: Right-Proving and Attribute-Blinding Self-Sovereign Authentication
Authors: Salleras Xavier , Rovira Sergi , Daza Vanesa
Published: February 2022

Nowadays, there are a plethora of services that are provided and paid for online, such as video streaming subscriptions, car-share, vehicle parking, purchasing tickets for events, etc. Online services usually issue tokens that are directly related to the identities of their users after they sign up to a platform; users need to authenticate themselves by using the same credentials each time they use the service. Likewise, when using in-person services, such as going to a concert, after paying for this service, the user usually receives a ticket, which proves that he/she has the right to use that service. In both scenarios, the main concerns surround the centralization of these systems and that they do not ensure customers’ privacy. The involved service providers are trusted third parties—authorities that offer services and handle private data about users. In this paper, we designed and implemented FORT, a decentralized system that allows customers to prove their rights to use specific services (either online or in-person) without revealing sensitive information. To achieve decentralization, we proposed a solution where all of the data are handled by a blockchain. We describe and uniquely identify users’ rights using non-fungible tokens (NFTs), and possession of these rights is demonstrated by using zero-knowledge proofs—cryptographic primitives that allow us to guarantee customers’ privacy. Furthermore, we provide benchmarks of FORT, which show that our protocol is efficient enough to be used in devices with low computing resources, such as smartphones or smartwatches, which are devices commonly used in our use case scenario.
Nonparametric Estimation of the Density Function of the Distribution of the Noise in CHARN Models
Authors: Ngatchou-Wandji Joseph , Ltaifa Marwa , Njamen Njomen Didier Alain , Shen Jia
Published: February 2022

This work is concerned with multivariate conditional heteroscedastic autoregressive nonlinear (CHARN) models with an unknown conditional mean function, conditional variance matrix function and density function of the distribution of noise. We study the kernel estimator of the latter function when the former are either parametric or nonparametric. The consistency, bias and asymptotic normality of the estimator are investigated. Confidence bound curves are given. A simulation experiment is performed to evaluate the performance of the results.
Expression of the Antimicrobial Peptide Piscidin 1 and Neuropeptides in Fish Gill and Skin: A Potential Participation in Neuro-Immune Interaction
Authors: Zaccone Giacomo , Capillo Gioele , Fernandes Jorge Manuel Oliveira , Kiron Viswanath , Lauriano Eugenia Rita , Alesci Alessio , Lo Cascio Patrizia , Guerrera Maria Cristina , Kuciel Michal , Zuwala Krystyna , Icardo Jose Manuel , Ishimatsu Atsushi , Murata Ryosuke , Amagai Takafumi , Germanà Antonino , Aragona Marialuisa
Published: February 2022

Antimicrobial peptides (AMPs) are found widespread in nature and possess antimicrobial and immunomodulatory activities. Due to their multifunctional properties, these peptides are a focus of growing body of interest and have been characterized in several fish species. Due to their similarities in amino-acid composition and amphipathic design, it has been suggested that neuropeptides may be directly involved in the innate immune response against pathogen intruders. In this review, we report the molecular characterization of the fish-specific AMP piscidin1, the production of an antibody raised against this peptide and the immunohistochemical identification of this peptide and enkephalins in the neuroepithelial cells (NECs) in the gill of several teleost fish species living in different habitats. In spite of the abundant literature on Piscidin1, the biological role of this peptide in fish visceral organs remains poorly explored, as well as the role of the neuropeptides in neuroimmune interaction in fish. The NECs, by their role as sensors of hypoxia changes in the external environments, in combination with their endocrine nature and secretion of immunomodulatory substances would influence various types of immune cells that contain piscidin, such as mast cells and eosinophils, both showing interaction with the nervous system. The discovery of piscidins in the gill and skin, their diversity and their role in the regulation of immune response will lead to better selection of these immunomodulatory molecules as drug targets to retain antimicrobial barrier function and for aquaculture therapy in the future.
A Tale of Toxin Promiscuity: The Versatile Pharmacological Effects of Hcr 1b-2 Sea Anemone Peptide on Voltage-Gated Ion Channels
Authors: Pinheiro-Junior Ernesto Lopes , Kalina Rimma , Gladkikh Irina , Leychenko Elena , Tytgat Jan , Peigneur Steve
Published: February 2022

Sea anemones are a rich source of biologically active compounds. Among approximately 1100 species described so far, Heteractis crispa species, also known as sebae anemone, is native to the Indo-Pacific area. As part of its venom components, the Hcr 1b-2 peptide was first described as an ASIC1a and ASIC3 inhibitor. Using Xenopus laevis oocytes and the two-electrode voltage-clamp technique, in the present work we describe the remarkable lack of selectivity of this toxin. Besides the acid-sensing ion channels previously described, we identified 26 new targets of this peptide, comprising 14 voltage-gated potassium channels, 9 voltage-gated sodium channels, and 3 voltage-gated calcium channels. Among them, Hcr 1b-2 is the first sea anemone peptide described to interact with isoforms from the Kv7 family and T-type Cav channels. Taken together, the diversity of Hcr 1b-2 targets turns this toxin into an interesting tool to study different types of ion channels, as well as a prototype to develop new and more specific ion channel ligands.
Evaluation of the Daily Change in PaO2/FiO2 Ratio as a Predictor of Abnormal Chest X-rays in Intensive Care Unit Patients Post Mechanical Ventilation Weaning: A Retrospective Cohort Study
Authors: Kwack Won-Gun
Published: February 2022

Background and Objectives: The routine daily chest X-ray (CXR) strategy is no longer recommended in intensive care unit (ICU) patients. However, it is difficult for intensivists to collectively accept the on-demand CXR strategy because of the ambiguous clinical criteria for conducting CXRs. This study evaluated the predictive value of the change in PaO2/FiO2 (PF ratio) for abnormal CXR findings in ICU patients after mechanical ventilation (MV). Materials and Methods: A retrospective cohort study was conducted between January 2016 and March 2021 on ICU patients with MV who had at least 48 h of MV, and stayed at least 72 h in the ICU post-MV. Routine daily CXRs and daily changes in the PF ratios were investigated during the three days post-MV. Results: The 186 patients included in the study had a median age of 77 years (interquartile range: 65–82), and 116 (62.4%) were men. One hundred and eight (58.1%) patients had abnormal CXR findings, defined as one or more abnormal CXRs among the daily CXRs during the three days post-extubation. The reintubation rate was higher in the abnormal CXR group (p = 0.01). Of the 558 CXRs (normal = 418, abnormal = 140) and PF ratios, the daily change in PF ratio had a significant predictive accuracy for abnormal CXR findings (AUROC = 0.741, p < 0.01). Conclusions: The change in PF ratio (the Youden index point: ≤−23) had a sensitivity of 65.7%, and a specificity of 79.9%. Based on these results, the daily change in the PF ratio could be utilized as a predictive indicator of abnormal CXRs in ICU patients after MV treatment.
Volumetric Scale-Up of a Packed-Bed Ion-Exchange System to Extract Phytate from Thin Stillage
Authors: Rodrigues Reis Cristiano E. , Hu Bo
Published: February 2022

Phytate is the main form of phosphorus in corn ethanol coproducts and poses digestion issues in monogastric-animal feed. Extracting phytate as a commodity chemical will bring extra revenue to the corn ethanol industry and reduces potential phosphorus pollution from livestock waste management. We assessed a simplified scale-up approach of an ion-exchange separation system applied to extract phytate from thin stillage using volumetric parameters and simplifications of the van Deemter model. Thin stillage is one of the main byproducts generated on dry-grind corn-to-ethanol plants and accounts for the liquid portion of the bottom product generated in the ethanol distillation process. Thin stillage is rich in dissolved phytate, which served as the basis for an ion-exchange extraction system developed with a scalability factor of 50. Under the evaluated conditions, similar breakthrough profiles were obtained when similar Péclet and Stanton numbers were maintained for the scales studied, demonstrating that a simple and straightforward scale-up can be attained if special attention is given to maintaining both parameters as the basis of calculations of the plate numbers of ion-exchange columns.
The Role of Nutraceutical Containing Polyphenols in Diabetes Prevention
Authors: Fernandes Iva , Oliveira Joana , Pinho Aryane , Carvalho Eugenia
Published: February 2022

Research in pharmacological therapy has led to the availability of many antidiabetic agents. New recommendations for precision medicine and particularly precision nutrition may greatly contribute to the control and especially to the prevention of diabetes. This scenario greatly encourages the search for novel non-pharmaceutical molecules. In line with this, the daily and long-term consumption of diets rich in phenolic compounds, together with a healthy lifestyle, may have a protective role against the development of type 2 diabetes. In the framework of the described studies, there is clear evidence that the bio accessibility, bioavailability, and the gut microbiota are indeed affected by: the way phenolic compounds are consumed (acutely or chronically; as pure compounds, extracts, or in-side a whole meal) and the amount and the type of phenolic compounds (ex-tractable or non-extractable/macromolecular antioxidants, including non-bioavailable polyphenols and plant matrix complexed structures). In this review, we report possible effects of important, commonly consumed, phenolic-based nutraceuticals in pre-clinical and clinical diabetes studies. We highlight their mechanisms of action and their potential effects in health promotion. Translation of this nutraceutical-based approach still requires more and larger clinical trials for better elucidation of the mechanism of action toward clinical applications.
Build, Share and Remix: 3D Printing for Speeding Up the Innovation Cycles in Ambient Ionisation Mass Spectrometry (AIMS)
Authors: García-Rojas Nancy Shyrley , Guillén-Alonso Héctor , Martínez-Jarquín Sandra , Moreno-Pedraza Abigail , Soto-Rodríguez Leonardo D. , Winkler Robert
Published: February 2022

Ambient ionisation mass spectrometry (AIMS) enables studying biological systems in their native state and direct high-throughput analyses. The ionisation occurs in the physical conditions of the surrounding environment. Simple spray or plasma-based AIMS devices allow the desorption and ionisation of molecules from solid, liquid and gaseous samples. 3D printing helps to implement new ideas and concepts in AIMS quickly. Here, we present examples of 3D printed AIMS sources and devices for ion transfer and manipulation. Further, we show the use of 3D printer parts for building custom AIMS sampling robots and imaging systems. Using 3D printing technology allows upgrading existing mass spectrometers with relatively low cost and effort.
Environmental Metabolomics Promises and Achievements in the Field of Aquatic Ecotoxicology: Viewed through the Pharmaceutical Lens
Authors: Dumas Thibaut , Courant Frédérique , Fenet Hélène , Gomez Elena
Published: February 2022

Scientists often set ambitious targets using environmental metabolomics to address challenging ecotoxicological issues. This promising approach has a high potential to elucidate the mechanisms of action (MeOAs) of contaminants (in hazard assessments) and to develop biomarkers (in environmental biomonitoring). However, metabolomics fingerprints often involve a complex mixture of molecular effects that are hard to link to a specific MeOA (if detected in the analytical conditions used). Given these promises and limitations, here we propose an updated review on the achievements of this approach. Metabolomics-based studies conducted on the effects of pharmaceutical active compounds in aquatic organisms provide a relevant means to review the achievements of this approach, as prior knowledge about the MeOA of these molecules could help overcome some shortcomings. This review highlighted that current metabolomics advances have enabled more accurate MeOA assessment, especially when combined with other omics approaches. The combination of metabolomics with other measured biological endpoints has also turned out to be an efficient way to link molecular effects to (sub)-individual adverse outcomes, thereby paving the way to the construction of adverse outcome pathways (AOPs). Here, we also discuss the importance of determining MeOA as a key strategy in the identification of MeOA-specific biomarkers for biomonitoring. We have put forward some recommendations to take full advantage of environmental metabolomics and thus help fulfil these promises.
Long-Term Accuracy Enhancement of Binary Neural Networks Based on Optimized Three-Dimensional Memristor Array
Authors: Yu Jie , Zhang Woyu , Dong Danian , Sun Wenxuan , Lai Jinru , Zheng Xu , Gong Tiancheng , Li Yi , Shang Dashan , Xing Guozhong , Xu Xiaoxin
Published: February 2022

In embedded neuromorphic Internet of Things (IoT) systems, it is critical to improve the efficiency of neural network (NN) edge devices in inferring a pretrained NN. Meanwhile, in the paradigm of edge computing, device integration, data retention characteristics and power consumption are particularly important. In this paper, the self-selected device (SSD), which is the base cell for building the densest three-dimensional (3D) architecture, is used to store non-volatile weights in binary neural networks (BNN) for embedded NN applications. Considering that the prevailing issues in written data retention on the device can affect the energy efficiency of the system’s operation, the data loss mechanism of the self-selected cell is elucidated. On this basis, we introduce an optimized method to retain oxygen ions and prevent their diffusion toward the switching layer by introducing a titanium interfacial layer. By using this optimization, the recombination probability of Vo and oxygen ions is reduced, effectively improving the retention characteristics of the device. The optimization effect is verified using a simulation after mapping the BNN weights to the 3D VRRAM array constructed by the SSD before and after optimization. The simulation results showed that the long-term recognition accuracy (greater than 105 s) of the pre-trained BNN was improved by 24% and that the energy consumption of the system during training can be reduced 25,000-fold while ensuring the same accuracy. This work provides high storage density and a non-volatile solution to meet the low power consumption and miniaturization requirements of embedded neuromorphic applications.
Microfluidic Immobilized Enzymatic Reactors for Proteomic Analyses—Recent Developments and Trends (2017–2021)
Authors: Nagy Cynthia , Szabo Ruben , Gaspar Attila
Published: February 2022

Given the strong interdisciplinary nature of microfluidic immobilized enzyme reactor (μ-IMER) technology, several branches of science contribute to its successful implementation. A combination of physical, chemical knowledge and engineering skills is often required. The development and application of μ-IMERs in the proteomic community are experiencing increasing importance due to their attractive features of enzyme reusability, shorter digestion times, the ability to handle minute volumes of sample and the prospect of on-line integration into analytical workflows. The aim of this review is to give an account of the current (2017–2021) trends regarding the preparation of microdevices, immobilization strategies, and IMER configurations. The different aspects of microfabrication (designs, fabrication technologies and detectors) and enzyme immobilization (empty and packed channels, and monolithic supports) are surveyed focusing on μ-IMERs developed for proteomic analysis. Based on the advantages and limitations of the published approaches and the different applications, a probable perspective is given.
Prediction of Surface Roughness as a Function of Temperature for SiO2 Thin-Film in PECVD Process
Authors: Amirzada Muhammad Rizwan , Khan Yousuf , Ehsan Muhammad Khurram , Rehman Atiq Ur , Jamali Abdul Aleem , Khatri Abdul Rafay
Published: February 2022

An analytical model to predict the surface roughness for the plasma-enhanced chemical vapor deposition (PECVD) process over a large range of temperature values is still nonexistent. By using an existing prediction model, the surface roughness can directly be calculated instead of repeating the experimental processes, which can largely save time and resources. This research work focuses on the investigation and analytical modeling of surface roughness of SiO2 deposition using the PECVD process for almost the whole range of operating temperatures, i.e., 80 to 450 °C. The proposed model is based on experimental data of surface roughness against different temperature conditions in the PECVD process measured using atomic force microscopy (AFM). The quality of these SiO2 layers was studied against an isolation layer in a microelectromechanical system (MEMS) for light steering applications. The analytical model employs different mathematical approaches such as linear and cubic regressions over the measured values to develop a prediction model for the whole operating temperature range of the PECVD process. The proposed prediction model is validated by calculating the percent match of the analytical model with experimental data for different temperature ranges, counting the correlations and error bars.
Therapeutic Applications of Programmable DNA Nanostructures
Authors: Aye Seaim , Sato Yusuke
Published: February 2022

Deoxyribonucleic acid (DNA) nanotechnology, a frontier in biomedical engineering, is an emerging field that has enabled the engineering of molecular-scale DNA materials with applications in biomedicine such as bioimaging, biodetection, and drug delivery over the past decades. The programmability of DNA nanostructures allows the precise engineering of DNA nanocarriers with controllable shapes, sizes, surface chemistries, and functions to deliver therapeutic and functional payloads to target cells with higher efficiency and enhanced specificity. Programmability and control over design also allow the creation of dynamic devices, such as DNA nanorobots, that can react to external stimuli and execute programmed tasks. This review focuses on the current findings and progress in the field, mainly on the employment of DNA nanostructures such as DNA origami nanorobots, DNA nanotubes, DNA tetrahedra, DNA boxes, and DNA nanoflowers in the biomedical field for therapeutic purposes. We will also discuss the fate of DNA nanostructures in living cells, the major obstacles to overcome, that is, the stability of DNA nanostructures in biomedical applications, and the opportunities for DNA nanostructure-based drug delivery in the future.
An Investigation into the Adsorption of Ammonium by Zeolite-Magnetite Composites
Authors: Huang Xiaoming , Wang Ning , Kang Zhang , Yang Xiao , Pan Min
Published: February 2022

The discharging of ammonium from industrial, domestic, and livestock sewage has caused eutrophication of the water environment. The objectives of this study are to synthesize magnetic zeolite (M-Zeo) by an eco-friendly, economical, and easy procedure and to investigate its suitability as an adsorbent to remove ammonium from an aqueous solution. Based on characterization from XRD, BET, and SEM-EDS, Fe3O4 was proved to successfully load on natural zeolite. The effect of pH, temperatures, reacting times, initial ammonium concentrations, and regeneration cycles on ammonium adsorption was examined by batch experiments. The ammonium adsorption process can be best described by the Freundlich isotherm and the maximum adsorptive capacity of 172.41 mg/g was obtained. Kinetic analysis demonstrated that the pseudo-second-order kinetic model gave the best description on the adsorption. The value of pH is a key factor and the maximum adsorption capacity was obtained at pH 8. By using a rapid sodium chloride regeneration method, the regeneration ratio was up to 97.03% after five regeneration cycles, suggesting that M-Zeo can be recycled and magnetically recovered. Thus, the economic-efficient, great ammonium affinity, and excellent regeneration characteristics of M-Zeo had an extensively promising utilization on ammonium treatment from liquid.
An Evaluation on the Impact of Ore Fragmented by Blasting on Mining Performance
Authors: Nikkhah Ayyub , Vakylabad Ali Behrad , Hassanzadeh Ahmad , Niedoba Tomasz , Surowiak Agnieszka
Published: February 2022

In open-pit mines, the blast operation should be effectively optimized, leading to minimization of production costs through the application of specific technical specifications. However, there is inadequate information in the literature to link blasting to comminution stages. To this end, the effective parameters for the performance of mining unit operations were scrutinized in this work. In this regard, the rock fragmentation distribution (RFD) caused by blasting was considered the main determinative criterion for providing the optimum conditions for the blasting operation at Sarcheshmeh copper mine. By carrying out a statistical analysis of the experimental data, operational parameters affecting the blasting were optimized. The relationship between parameters was obtained using the technique of regression and in accordance with the evaluation criterion under which correlation coefficient (R2) was used to determine the best fitting model. A high correlation coefficient of the loading cycle of the machine’s bucket (Cl) with the independent variables showed that the C1 was more affected by the RFD, as well as the dimensions of the blast block. Because of the wide variations in the nature and structure of rock mass in different mines, in each case, sufficient data should be collected, and these relationships should be analyzed statistically for each individual mine showing wide ranges of fractures and cracks. Therefore, due to these wide variations of ore characteristics, with the current data it seems very difficult to quickly find a significant operational relationship between downstream processes such as crushing efficiency and blasting operations. Therefore, the focus of this research was limited to the effective parameters for blast efficiency. According to the analysis of the data obtained from 20 blasts under different operating conditions, the diameter of the hole was 241.3 mm (such as blast number 20), the ratio of length to width of the explosive block was about 6 (average blasts with high fragmentation efficiency), and the best index of mining operations was 0.22 (such as blast number 20).
Berberine, a Herbal Metabolite in the Metabolic Syndrome: The Risk Factors, Course, and Consequences of the Disease
Authors: Och Anna , Och Marek , Nowak Renata , Podgórska Dominika , Podgórski Rafał
Published: February 2022

In recent years, the health of patients exposed to the consequences of the metabolic syndrome still requires the search for new solutions, and plant nutraceuticals are currently being intensively investigated. Berberine is a plant alkaloid possessing scientifically determined mechanisms of the prevention of the development of atherosclerosis, type 2 diabetes, and obesity, as well as cardiovascular complications and cancer. It positively contributes to elevated levels of fasting, postprandial blood glucose, and glycosylated hemoglobin, while decreasing insulin resistance. It stimulates glycolysis, improving insulin secretion, and inhibits gluconeogenesis and adipogenesis in the liver; by reducing insulin resistance, berberine also improves ovulation. The anti-obesity action of berberine has been also well-documented. Berberine acts as an anti-sclerotic, lowering the LDL and testosterone levels. The alkaloid exhibits an anti-inflammatory property by stalling the expression of cyclooxygenase 2 (COX-2) and prostaglandin E2. Berberine is neuroprotective and acts as an antidepressive. However, the outcomes in psychiatric patients are nonspecific, as it has been shown that berberine improves metabolic parameters in schizophrenic patients, acting as an adjuvant during antipsychotic treatment. Berberine acts as an anticancer option by inducing apoptosis, the cell cycle arrest, influencing MAPK (mitogen-activated protein kinase), and influencing transcription regulation. The inhibition of carcinogenesis is also combined with lipid metabolism.
Experimental Study of the Thermal Decomposition Properties of Binary Imidazole Ionic Liquid Mixtures
Authors: Yang Fan , Zhang Xin , Pan Yong , He Hongpeng , Ni Yuqing , Wang Gan , Jiang Juncheng
Published: February 2022

Ionic liquids (ILs) have a wide range of applications, owing to their negligible vapor pressure, high electrical conductivity, and low melting point. However, the thermal hazards of ILs and their mixtures are also non-negligible. In this study, the thermal hazards of various binary imidazolium ionic liquids (BIIL) mixtures were investigated. The effects of parent salt components and molar ratios on the thermal decomposition temperature (Td) and flashpoint temperature (Tf) are investigated. It is found that both Td and Tf increase as the proportion of highly thermally stable components in BIIL mixtures increases. Furthermore, the decomposition process of BIIL mixtures can be divided into two stages. For most molar ratios, the Tf of the BIIL mixtures is in the first stage of thermal decomposition. When the proportion of highly thermally stable components is relatively high, Tf is in the second stage of thermal decomposition. The flammability is attributed to the produced combustible gases during the thermal decomposition process. This work would be reasonably expected to provide some guidance for the safety design and application of IL mixtures for engineering.
Optimization of the Extraction of Proanthocyanidins from Grape Seeds Using Ultrasonication-Assisted Aqueous Ethanol and Evaluation of Anti-Steatosis Activity In Vitro
Authors: Thilakarathna Wasitha P. D. W. , Rupasinghe H. P. Vasantha
Published: February 2022

Conventional extraction methods of proanthocyanidins (PAC) are based on toxic organic solvents, which can raise concerns about the use of extracts in supplemented food and nutraceuticals. Thus, a PAC extraction method was developed for grape seeds (GS) and grape seed powder using food-grade ethanol by optimizing the extraction conditions to generate the maximum yield of PAC. Extraction parameters, % ethanol, solvent: solid (s:s) ratio, sonication time, and temperature were optimized by the central composite design of the response surface method. The yields of PAC under different extraction conditions were quantified by the methylcellulose precipitable tannin assay. The final optimum conditions were 47% ethanol, 10:1 s:s ratio (v:w), 53 min sonication time, and 60 °C extraction temperature. High-performance liquid chromatography analysis revealed the presence of catechin, procyanidin B2, oligomeric and polymeric PAC in the grape seed-proanthocyanidin extracts (GS-PAC). GS-PAC significantly reduced reactive oxygen species and lipid accumulation in the palmitic-acid-induced mouse hepatocytes (AML12) model of steatosis. About 50% of the PAC of the GS was found to be retained in the by-product of wine fermentation. Therefore, the developed ethanol-based extraction method is suitable to produce PAC-rich functional ingredients from grape by-products to be used in supplemented food and nutraceuticals.
Structure–Activity Relationship of the Thiacalix[4]arenes Family with Sulfobetaine Fragments: Self-Assembly and Cytotoxic Effect against Cancer Cell Lines
Authors: Yakimova Luidmila , Kunafina Aisylu , Nugmanova Aigul , Padnya Pavel , Voloshina Alexandra , Petrov Konstantin , Stoikov Ivan
Published: February 2022

Regulating the structure of macrocyclic host molecules and supramolecular assemblies is crucial because the structure–activity relationship often plays a role in governing the properties of these systems. Herein, we propose and develop an approach to the synthesis of the family of sulfobetaine functionalized thiacalix[4]arenes with regulation of the self-assembly and cytotoxic effect against cancer cell lines. The dynamic light scattering method showed that the synthesized macrocycles in cone, partial cone and 1,3-alternate conformations form submicron-sized particles with Ag+ in water, but the particle size and polydispersity of the systems studied depend on the macrocycle conformation. Based on the results obtained by 1H and 1H-1H NOESY NMR spectroscopy and transmission electron microscopy for the macrocycles and their aggregates with Ag+, a coordination scheme for the Ag+ and different conformations of p-tert-butylthiacalix[4]arene functionalized with sulfobetaine fragments was proposed. The type of coordination determines the different shapes of the associates. Cytotoxic properties are shown to be controlled by the shape of associates, with the highest activity demonstrated by thiacalix[4]arenes in partial cone conformation. This complex partial cone/Ag+ is two times higher than the reference drug imatinib mesylate. High selectivity against cervical carcinoma cell line indicates the prospect of their using as components of new anticancer system.
Micro- and Nanocapsules Based on Artificial Peptides
Authors: Feng Huayang
Published: February 2022

The encapsulation of active ingredients into solid capsules from biodegradable materials has received significant attention over the last decades. In this short review, we focus on the formation of micro- and nano-sized capsules and emulsions based on artificial peptides as a fully degradable material. It deals with various approaches for the preparation of peptide-based capsules as well as with their crucial properties such as size and stability. We categorize all preparation procedures into three basic approaches: self-assembly, polymerization and crosslinking, and layer-by-layer technology. This article is meant to offer a short overview over all successful methods suitable for obtaining access to these very promising carrier systems.