bluuebunny/crossref_metadata_2025 huggingface dataset:
Biomimetic Calcium Phosphate Coatings for Bioactivation of Titanium Implant Surfaces: Methodological Approach and In Vitro Evaluation of Biocompatibility
Authors: Kreller Thomas , Sahm Franziska , Bader Rainer , Boccaccini Aldo R. , Jonitz-Heincke Anika , Detsch Rainer
Published: June 2021

Ti6Al4V as a common implant material features good mechanical properties and corrosion resistance. However, untreated, it lacks bioactivity. In contrast, coatings with calcium phosphates (CaP) were shown to improve cell–material interactions in bone tissue engineering. Therefore, this work aimed to investigate how to tailor biomimetic CaP coatings on Ti6Al4V substrates using modified biomimetic calcium phosphate (BCP) coating solutions. Furthermore, the impact of substrate immersion in a 1 M alkaline CaCl2 solution (pH = 10) on subsequent CaP coating formation was examined. CaP coatings were characterized via scanning electron microscopy, x-ray diffraction, energy-dispersive x-ray spectroscopy, and laser-scanning microscope. Biocompatibility of coatings was carried out with primary human osteoblasts analyzing cell morphology, proliferation, collagen type 1, and interleukin 6 and 8 release. Results indicate a successful formation of low crystalline hydroxyapatite (HA) on top of every sample after immersion in each BCP coating solution after 14 days. Furthermore, HA coating promoted cell proliferation and reduced the concentration of interleukins compared to the uncoated surface, assuming increased biocompatibility.
A 3D Finite Element Analysis Model of Single Implant-Supported Prosthesis under Dynamic Impact Loading for Evaluation of Stress in the Crown, Abutment and Cortical Bone Using Different Rehabilitation Materials
Authors: Cantó-Navés Oriol , Medina-Galvez Raul , Marimon Xavier , Ferrer Miquel , Figueras-Álvarez Óscar , Cabratosa-Termes Josep
Published: June 2021

In the literature, many researchers investigated static loading effects on an implant. However, dynamic loading under impact loading has not been investigated formally using numerical methods. This study aims to evaluate, with 3D finite element analysis (3D FEA), the stress transferred (maximum peak and variation in time) from a dynamic impact force applied to a single implant-supported prosthesis made from different materials. A 3D implant-supported prosthesis model was created on a digital model of a mandible section using CAD and reverse engineering. By setting different mechanical properties, six implant-supported prostheses made from different materials were simulated: metal (MET), metal-ceramic (MCER), metal-composite (MCOM), carbon fiber-composite (FCOM), PEEK-composite (PKCOM), and carbon fiber-ceramic (FCCER). Three-dimensional FEA was conducted to simulate the collision of 8.62 g implant-supported prosthesis models with a rigid plate at a speed of 1 m/s after a displacement of 0.01 mm. The stress peak transferred to the crown, titanium abutment, and cortical bone, and the stress variation in time, were assessed.
Cartilage Tissue Engineering by Extrusion Bioprinting: Process Analysis, Risk Evaluation, and Mitigation Strategies
Authors: Petretta Mauro , Desando Giovanna , Grigolo Brunella , Roseti Livia
Published: June 2021

Extrusion bioprinting is considered promising in cartilage tissue engineering since it allows the fabrication of complex, customized, and living constructs potentially suitable for clinical applications. However, clinical translation is often complicated by the variability and unknown/unsolved issues related to this technology. The aim of this study was to perform a risk analysis on a research process, consisting in the bioprinting of a stem cell-laden collagen bioink to fabricate constructs with cartilage-like properties. The method utilized was the Failure Mode and Effect Analysis/Failure Mode and Effect Criticality Analysis (FMEA/FMECA) which foresees a mapping of the process to proactively identify related risks and the mitigation actions. This proactive risk analysis allowed the identification of forty-seven possible failure modes, deriving from seventy-one potential causes. Twenty-four failure modes displayed a high-risk level according to the selected evaluation criteria and threshold (RPN > 100). The results highlighted that the main process risks are a relatively low fidelity of the fabricated structures, unsuitable parameters/material properties, the death of encapsulated cells due to the shear stress generated along the nozzle by mechanical extrusion, and possible biological contamination phenomena. The main mitigation actions involved personnel training and the implementation of dedicated procedures, system calibration, printing conditions check, and, most importantly, a thorough knowledge of selected biomaterial and cell properties that could be built either through the provided data/scientific literature or their preliminary assessment through dedicated experimental optimization phase. To conclude, highlighting issues in the early research phase and putting in place all the required actions to mitigate risks will make easier to develop a standardized process to be quickly translated to clinical use.
Tribochemical Interactions between Graphene and ZDDP in Friction Tests for Uncoated and W-DLC-Coated HS6-5-2C Steel
Authors: Kowalczyk Joanna , Madej Monika , Dzięgielewski Wojciech , Kulczycki Andrzej , Żółty Magdalena , Ozimina Dariusz
Published: June 2021

If a lubricant contains structures capable of conducting energy, reactions involving zinc dialkyldithiophosphate (ZDDP) may take place both very close to and away from the solid surfaces, with this indicating that ZDDP can be a highly effective anti-wear (AW) additive. The central thesis of this article is that the tribocatalytic effect is observed only when the energy emitted by the solids is transmitted by ordered molecular structures present in the lubricant, e.g., graphene. The friction tests were carried out for 100Cr6 steel balls in a sliding contact with uncoated or W-DLC-coated HS6-5-2C steel discs in the presence of polyalphaolefin 8 (PAO 8) as the lubricant, which was enhanced with graphene and/or ZDDP. There is sufficient evidence of the interactions occurring between ZDDP and graphene and their effects on the tribological performance of the system. It was also found that the higher the concentration of zinc in the wear area, the lower the wear. This was probably due to the energy transfer resulting from the catalytic decomposition of ZDDP molecules. Graphene, playing the role of the catalyst, contributed to that energy transfer.
Corrosion Resistance of Al–CNT Metal Matrix Composites
Authors: Popov Vladimir V. , Pismenny Alla , Larianovsky Natalya , Lapteva Anna , Safranchik Daniel
Published: June 2021

The design of aluminium–graphite metal matrix composites (MMCs) with advanced mechanical properties and high corrosion resistance is in demand for aerospace, transportation, and industrial applications. Breakthroughs in this field are limited due to the tendency of aluminium–graphite MMCs to corrode. In the present research, aluminium-based MMCs were produced by a relatively novel combined two-staged method. Multiwall carbon nanotubes (MWCNTs) were added into molten Al1070 and processed by high-pressure die casting followed by cyclic extrusion. For the composites produced by this method, it was previously demonstrated that mechanical properties are improved in comparison with pure aluminium alloys. In the current study, the manufactured Al–MWCNT composites were investigated by electrochemical tests (such as open circuit potential), potentiodynamic tests, linear polarization tests, and electrochemical impedance spectra to understand the corrosion resistance of the obtained composite material. The experimental testing of the corrosion resistance of Al–MWCNT MMCs showed that due to the advantages of the fabrication method, the addition of CNTs to aluminium does not cause a radical decrease of corrosion resistance.
Removal of Pesticides from Waters by Adsorption: Comparison between Synthetic Zeolites and Mesoporous Silica Materials. A Review
Authors: Andrunik Magdalena , Bajda Tomasz
Published: June 2021

Pesticides are pollutants found in wastewater due to increasing agricultural activities over the years. Inappropriate dosing of pesticides results in the dispersal of active ingredients in the environment. The complete removal of pesticides from wastewater is an immediate concern due to their high toxicity and mobility. At present, adsorption is one of the most widely used methods for pesticide removal, in which synthetic zeolites and mesoporous silica materials are extensively applied. This article presents a systematic and comparative review of the applications and comparison of these adsorbents, based on the data reported in the literature. The paper summarizes the information collected from various studies, including the type of adsorbents and pesticides used, experimental conditions, and results of each work. The studies analyzed were laboratory-based and show potential advantages for the treatment of pesticide-bearing waters using functionalized and unfunctionalized synthetic zeolites and mesoporous silica materials. As a whole, functionalized materials are reported to exhibit better removal performance for different pesticides than conventional materials. It is expected that the results of this review will help researchers to establish a powerful strategy for the abatement of pesticides in wastewater.
Tribological Behavior of Carbon-Based Nanomaterial-Reinforced Nickel Metal Matrix Composites
Authors: Patil Amit , Walunj Ganesh , Ozdemir Furkan , Gupta Rajeev Kumar , Borkar Tushar
Published: June 2021

Carbon nanotubes (CNTs) and graphene nanoplatelets (GNPs) with exceptional mechanical, thermal, chemical, and electrical properties are enticing reinforcements for fabricating lightweight, high-strength, and wear-resistant metal matrix composites with superior mechanical and tribological performance. Nickel–carbon nanotube composite (Ni-CNT) and nickel–graphene nanoplatelet composite (Ni-GNP) were fabricated via mechanical milling followed by the spark plasma sintering (SPS) technique. The Ni-CNT/GNP composites with varying reinforcement concentrations (0.5, 2, and 5 wt%) were ball milled for twelve hours to explore the effect of reinforcement concentration and its dispersion in the nickel microstructure. The effect of varying CNT/GNP concentration on the microhardness and the tribological behavior was investigated and compared with SPS processed monolithic nickel. Ball-on-disc tribological tests were performed to determine the effect of different structural morphologies of CNTs and GNPs on the wear performance and coefficient of friction of these composites. Experimental results indicate considerable grain refinement and improvement in the microhardness of these composites after the addition of CNTs/GNPs in the nickel matrix. In addition, the CNTs and GNPs were effective in forming a lubricant layer, enhancing the wear resistance and lowering the coefficient of friction during the sliding wear test, in contrast to the pure nickel counterpart. Pure nickel demonstrated the highest CoF of ~0.9, Ni-0.5CNT and Ni-0.5GNP exhibited a CoF of ~0.8, whereas the lowest CoF of ~0.2 was observed for Ni-2CNT and Ni-5GNP composites. It was also observed that the uncertainty of wear resistance and CoF in both the CNT/GNP-reinforced composites increased when loaded with higher reinforcement concentrations. The wear surface was analyzed using scanning electron microscopy (SEM) and energy dispersive spectroscopy (EDS) analysis to elucidate the wear mechanism in these composites.
Marine Antitumor Peptide Dolastatin 10: Biological Activity, Structural Modification and Synthetic Chemistry
Authors: Gao Gang , Wang Yanbing , Hua Huiming , Li Dahong , Tang Chunlan
Published: June 2021

Dolastatin 10 (Dol-10), a leading marine pentapeptide isolated from the Indian Ocean mollusk Dolabella auricularia, contains three unique amino acid residues. Dol-10 can effectively induce apoptosis of lung cancer cells and other tumor cells at nanomolar concentration, and it has been developed into commercial drugs for treating some specific lymphomas, so it has received wide attention in recent years. In vitro experiments showed that Dol-10 and its derivatives were highly lethal to common tumor cells, such as L1210 leukemia cells (IC50 = 0.03 nM), small cell lung cancer NCI-H69 cells (IC50 = 0.059 nM), and human prostate cancer DU-145 cells (IC50 = 0.5 nM), etc. With the rise of antibody-drug conjugates (ADCs), milestone progress was made in clinical research based on Dol-10. A variety of ADCs constructed by combining MMAE or MMAF (Dol-10 derivatives) with a specific antibody not only ensured the antitumor activity of the drugs themself but also improved their tumor targeting and reduced the systemic toxicity. They are currently undergoing clinical trials or have been approved for marketing, such as Adcetris®, which had been approved for the treatment of anaplastic large T-cell systemic malignant lymphoma and Hodgkin lymphoma. Dol-10, as one of the most medically valuable natural compounds discovered up to now, has brought unprecedented hope for tumor treatment. It is particularly noteworthy that, by modifying the chemical structure of Dol-10 and combining with the application of ADCs technology, Dol-10 as a new drug candidate still has great potential for development. In this review, the biological activity and chemical work of Dol-10 in the advance of antitumor drugs in the last 35 years will be summarized, which will provide the support for pharmaceutical researchers interested in leading exploration of antitumor marine peptides.
Ethnicity-Specific Normative Models of Quadruple Test as a Screening Test for Down Syndrome
Authors: Praikaew Praetip , Traisrisilp Kuntharee , Wanapirak Chanane , Sekararithi Ratanaporn , Tongsong Theera
Published: June 2021

Background and Objectives: To establish normative models for median levels of serum biomarkers of the second trimester quad test (alpha-fetoprotein: AFP; free beta-human gonadotropins: hCG; inhibin-A; and unconjugated estriol: uE3) specific to Thai women and to compare multiples of the median (MoMs) derived from ethnicity-specific models and those derived from Caucasian models with ethnic correction. Materials and Methods: A cross-sectional study was undertaken in a tertiary, medical teaching center among low-risk pregnant Thai women between 14 and 21 weeks of gestation to measure the levels of the four serum biomarkers. The measured values of each biomarker were analyzed using the multivariable factorial polynomial technique for quantile regression as a function of gestational age and maternal weight. Results: The Thai-specific normative models for the four biomarkers were generated and available for use. The MoMs of all individuals generated from our models were significantly different from conventional (Caucasian) models with ethnic correction (Wilcoxon signed-rank test; p < 0.0001 for all biomarkers). The MoMs of AFP and hCG from both methods were in agreement, but those from Thai-specific models were significantly higher. However, those of inhibin-A and uE3 were markedly different and ethnic correction was unlikely to be useful. Conclusions: The Thai-specific normative models of the quad test as a function of gestational age and maternal weight were constructed using multivariable factorial polynomial models, better than simple quantile regression or log-linear regression used in earlier decades. The analysis of MoMs supports the use of ethnicity-specific models instead of Caucasian models with ethnic correction.
Relationship between Microstructure Evolution and Tensile Properties of AlSi10Mg Alloys with Varying Mg Content and Solidification Cooling Rates
Authors: Gandolfi Maressa , Xavier Marcella Gautê Cavalcante , Gomes Leonardo Fernandes , Reyes Rodrigo André Valenzuela , Garcia Amauri , Spinelli José Eduardo
Published: June 2021

This work explored and contrasted the effect of microstructure on the tensile properties of AlSi10Mg alloys generated by transient directional solidification depending on variations in cooling rate and magnesium (Mg) content (i.e., 0.45 and 1 wt.% Mg), with a focus on understanding the dendritic growth and phases constitution. Optical and scanning electron (SEM) microscopies, CALPHAD, and thermal analysis were used to describe the microstructure, forming phases, and resulting tensile properties. The findings showed that the experimental evolution of the primary dendritic spacing is very similar when both directionally solidified (DS) Al-10 wt.% Si-0.45 wt.% Mg and Al-10 wt.% Si-1 wt.% Mg alloys samples are compared. The secondary dendritic spacing was lower for the alloy with more Mg, especially considering the range of high growth velocities. Moreover, a greater fraction of (Al + Si + Mg2Si) ternary eutectic islands surrounding the α-Al dendritic matrix was noted for the alloy with 1 wt.% Mg. As a result of primary dendritic spacings greater than 180 μm related to lower cooling rates, slightly higher tensile properties were attained for the Al-10 wt.% Si-0.45 wt.% Mg alloy. In contrast, combining dendritic refining (<150 μm) and a larger Mg2Si fraction, fast-solidified DS Al-10 wt.% Si-1 wt.% Mg samples exhibited higher tensile strength and elongation. The control of cooling rate and fineness of the dendritic array provided a new insight related to the addition of Mg in slightly higher levels than conventional ones, capable of achieving a better balance of tensile properties in AlSi10Mg alloys.
Laser Surface Modification of TC21 (α/β) Titanium Alloy Using a Direct Energy Deposition (DED) Process
Authors: Elshazli Ahmed Magdi , Elshaer Ramadan N. , Hussein Abdel Hamid Ahmed , Al-Sayed Samar Reda
Published: June 2021

The TC21 alloy (Ti-6Al-3Mo-1.9Nb-2.2Sn-2.2Zr-1.5Cr) is considered a new titanium alloy that replaced the commercial Ti-6Al-4V alloy in aerospace applications due to its higher operating temperatures. Recently, direct energy deposition was usually applied to enhance the hardness, tribological properties, and corrosion resistance for many alloys. Consequently, this study was performed by utilizing direct energy deposition (DED) on TC21 (α/β) titanium alloy to improve their mechanical properties by depositing a mixture powder of stellite-6 (Co-based alloy) and tungsten carbides particles (WC). Different WC percentages were applied to the surfaces of TC21 using a 4 kW continuous-wave fiber-coupled diode laser at a constant powder feeding rate. This study aimed to obtain a uniform distribution of hard surfaces containing undissolved WC particles that were dispersed in a Co-based alloy matrix to enhance the wear resistance of such alloys. Scanning electron microscopy, energy dispersive X-ray analysis (EDAX), and X-ray diffractometry (XRD) were used to characterize the deposited layers. New constituents and intermetallic compounds were found in the deposited layers. The microhardness was measured for all deposited layers and wear resistance was evaluated at room temperature using a dry sliding ball during a disk abrasion test. The results showed that the microstructure of the deposited layer consisted of a hypereutectic structure and undissolved tungsten carbide dispersed in the matrix of the Co-based alloy that depended on the WC weight fraction. The microhardness values increased with increasing WC weight fraction in the deposited powder by more than threefold as compared with the as-cast samples. A notable enhancement of wear resistance of the deposited layers was thus achieved.
Mineralogical Analysis of Bentonite from the ABM5 Heater Experiment at Äspö Hard Rock Laboratory, Sweden
Authors: Kaufhold Stephan , Dohrmann Reiner , Ufer Kristian , Svensson Daniel , Sellin Patrik
Published: June 2021

The present study reports on the analysis of all blocks of the ABM5 test, which is a medium scale bentonite buffer deposition test. In contrast to similar tests, the ABM5 was conducted at higher temperature (up to 250 °C). The aim of the study was to characterize the chemical and mineralogical reactions and to identify the effect of the extraordinarily high temperature. Reactions observed were similar to those observed in previous and/or similar tests covering cation exchange, anion inflow, dissolution and precipitation of C- and S-phases, Fe corrosion, and Mg increase at the heater. Neither the type nor the extent of the different reactions could be related to the significantly higher temperature. However, due to the absence of lubricant used between heater and bentonite, it could be proved that the calcite previously present was dissolved and precipitated as siderite at the contact, pointing towards the importance of the presence of carbonate when considering different Fe corrosion products. Moreover, for the first time, a decrease of the Mg content at the heater was observed, which was probably because a Mg-rich clay was used. The reasons for Mg increase or decrease are still not completely understood.
Thermodynamic Analysis of Precipitation Characteristics of Rare Earth Elements with Sulfate in Comparison with Other Common Precipitants
Authors: Han Kenneth N. , Kim Rina
Published: June 2021

The selective precipitation of rare earth elements (REEs) in acidic media often plays a key role in the effective extraction of these elements from various sources such as ores and recycling streams. In this study, the precipitation characteristics of REEs with sulfate, a frequently used precipitant, were carefully examined, and the results were compared with those of other precipitants, such as phosphate, oxalate, and fluoride/carbonate systems. Emphasis is given on various forms of precipitates, such as anhydrous sulfate, octa-hydrated sulfate, and sodium double salt, in which the sodium double salt was compared with the anionic double salt precipitation of the fluoride-carbonate system. It was found that anions such as Cl−, NO3−, and SO42− play an important role in the precipitation behavior, particularly through complexation with the dissolved REEs. In general, the effectiveness of precipitation follows the order of sodium double salt, a hydrated form of sulfate, and anhydrous sulfate. In this study, it was observed that the synergistic role of a double salt precipitation, either cationic or anionic, is frequently as effective as that of oxalate and phosphate, even in a low pH range.
Status of Recovery of Strategic Metals from Spent Secondary Products
Authors: Xolo Luthando , Moleko-Boyce Pulleng , Makelane Hlamulo , Faleni Nobathembu , Tshentu Zenixole R.
Published: June 2021

The need to drive towards sustainable metal resource recovery from end-of-cycle products cannot be overstated. This review attempts to investigate progress in the development of recycling strategies for the recovery of strategic metals, such as precious metals and base metals, from catalytic converters, e-waste, and batteries. Several methods for the recovery of metal resources have been explored for these waste streams, such as pyrometallurgy, hydrometallurgy, and biohydrometallurgy. The results are discussed, and the efficiency of the processes and the chemistry involved are detailed. The conversion of metal waste to high-value nanomaterials is also presented. Process flow diagrams are also presented, where possible, to represent simplified process steps. Despite concerns about environmental effects from processing the metal waste streams, the gains for driving towards a circular economy of these waste streams are enormous. Therefore, the development of greener processes is recommended. In addition, countries need to manage their metal waste streams appropriately and ensure that this becomes part of the formal economic activity and, therefore, becomes regulated.
Rosin Derivatives as a Platform for the Antiviral Drug Design
Authors: Popova Larisa , Ivanchenko Olga , Pochkaeva Evgeniia , Klotchenko Sergey , Plotnikova Marina , Tsyrulnikova Angelica , Aronova Ekaterina
Published: June 2021

The increased complexity due to the emergence and rapid spread of new viral infections prompts researchers to search for potential antiviral and protective agents for mucous membranes among various natural objects, for example, plant raw materials, their individual components, as well as the products of their chemical modification. Due to their structure, resin acids are valuable raw materials of natural origin to synthesize various bioactive substances. Therefore, the purpose of this study was to confirm the possibility of using resin acid derivatives for the drug design. As a result, we studied the cytotoxicity and biological activity of resin acid derivatives. It was shown that a slight decrease in the viral load in the supernatants was observed upon stimulation of cells (II) compared with the control. When using PASS-online modeling (Prediction of Activity Spectra for Substances), the prediction of the biological activity spectrum showed that compound (I) is capable of exhibiting antiviral activity against the influenza virus. The use of the SWISS-ADME webserver to reveal the drug-like properties of compounds did not directly indicate the presence of antiviral activity. These results indicate the potential of resin acid derivatives as a starting point for extensive research in the study of biological activity.
Anthocyanin Recovery from Grape by-Products by Combining Ohmic Heating with Food-Grade Solvents: Phenolic Composition, Antioxidant, and Antimicrobial Properties
Authors: Coelho Marta , Silva Sara , Costa Eduardo , Pereira Ricardo N. , Rodrigues António Sebastião , Teixeira José António , Pintado Manuela
Published: June 2021

Usually, wine-making by-products are discarded, presenting a significant environmental impact. However, they can be used as a source of bioactive compounds. Moreover, consumers’ increasing demand for naturally nutritious and healthy products requires new formulations and food product improvement, together with sustainable, environmentally friendly extraction methods. Thus, this work aimed to compare ohmic heating (OH) with conventional methodology (CONV), using food-grade solvents, mainly water, compared to standard methanol extraction of anthocyanins. No significant differences were found between the CONV and OH for total phenolic compounds, which were 2.84 ± 0.037 and 3.28 ± 0.46 mg/g DW gallic acid equivalent, respectively. The same tendency was found for antioxidant capacity, where CONV and OH presented values of 2.02 ± 0.007 g/100 g and 2.34 ± 0.066 g/100 g ascorbic acid equivalent, respectively. The major anthocyanins identified were malvidin-3-O-acetylglucoside, delphinidin-3-O-glucoside, petunidine-3-O-glucoside, cyanidin-3-O-glucoside, and peonidine-3-O-glucoside. These extracts displayed antimicrobial potential against microorganisms such as Yersinia enterocolitica, Pseudomonas aeruginosa, Salmonella enteritidis, methicillin-sensitive Staphylococcus aureus, a methicillin-resistant Staph. aureus (MRSA), and Bacillus cereus. In conclusion, OH provides similar recovery yields with reduced treatment times, less energy consumption, and no need for organic solvents (green extraction routes). Thus, OH combined with water and citric acid allows a safe anthocyanin extraction from grape by-products, thus avoiding the use of toxic solvents such as methanol, and with high biological potential, including antimicrobial and antioxidant activity.
Phytochemical Characterization of Olea europaea L. Cultivars of Cilento National Park (South Italy) through NMR-Based Metabolomics
Authors: Esposito Assunta , De Luca Pietro Filippo , Graziani Vittoria , D’Abrosca Brigida , Fiorentino Antonio , Scognamiglio Monica
Published: June 2021

Olea europaea germplasm is constituted by a huge number of cultivars, each one characterized by specific features. In this context, endemic cultivars evolved for a very long period in a precise local area, developing very specific traits. These characteristics include the production and accumulation of phytochemicals, many of which are also responsible for the nutraceutical value of the drupes and of the oils therefrom. With the aim of obtaining information on the phytochemical profile of drupes of autochthonous cultivars of Cilento, Vallo di Diano and Alburni National Park, a metabolomics-based study was carried out on 19 selected cultivars. Multivariate data analysis of 1H-NMR data and 2D NMR analyses allowed the rapid identification of metabolites that were qualitatively and/or quantitatively varying among the cultivars. This study allowed to identify the cultivars Racioppella, Guglia, Pizzulella, Oliva amara, and Racioppa as the richest in health-promoting phenolic compounds. Furthermore, it showed a significant variability among the different cultivars, suggesting the possibility of using metabolic fingerprinting approaches for cultivar differentiation, once that further studies aimed at assessing the influence of growing conditions and environmental factors on the chemical profiles of single cultivars are carried out.
Analyzing Discrepancies in Chemical-Shift Predictions of Solid Pyridinium Fumarates
Authors: Dračínský Martin
Published: June 2021

Highly accurate chemical-shift predictions in molecular solids are behind the success and rapid development of NMR crystallography. However, unusually large errors of predicted hydrogen and carbon chemical shifts are sometimes reported. An understanding of these deviations is crucial for the reliability of NMR crystallography. Here, recently reported large deviations of predicted hydrogen and carbon chemical shifts of a series of solid pyridinium fumarates are thoroughly analyzed. The influence of the geometry optimization protocol and of the computational level of NMR calculations on the accuracy of predicted chemical shifts is investigated. Periodic calculations with GGA, meta-GGA and hybrid functionals are employed. Furthermore, molecular corrections at the coupled-cluster singles-and-doubles (CCSD) level are calculated. The effect of nuclear delocalization on the structure and NMR shielding is also investigated. The geometry optimization with a computationally demanding hybrid functional leads to a substantial improvement in proton chemical-shift predictions.
Combination of Heme Oxygenase-1 Inhibition and Sigma Receptor Modulation for Anticancer Activity
Authors: Romeo Giuseppe , Ciaffaglione Valeria , Amata Emanuele , Dichiara Maria , Calabrese Loredana , Vanella Luca , Sorrenti Valeria , Grosso Salvo , D’Amico Agata Grazia , D’Agata Velia , Intagliata Sebastiano , Salerno Loredana
Published: June 2021

Cancer is a multifactorial disease that may be tackled by targeting different signaling pathways. Heme oxygenase-1 (HO-1) and sigma receptors (σRs) are both overexpressed in different human cancers, including prostate and brain, contributing to the cancer spreading. In the present study, we investigated whether HO-1 inhibitors and σR ligands, as well a combination of the two, may influence DU145 human prostate and U87MG human glioblastoma cancer cells proliferation. In addition, we synthesized, characterized, and tested a small series of novel hybrid compounds (HO-1/σRs) 1–4 containing the chemical features needed for HO-1 inhibition and σR modulation. Herein, we report for the first time that targeting simultaneously HO-1 and σR proteins may be a good strategy to achieve increased antiproliferative activity against DU145 and U87MG cells, with respect to the mono administration of the parent compounds. The obtained outcomes provide an initial proof of concept useful to further optimize the structure of HO-1/σRs hybrids to develop novel potential anticancer agents.
Biosynthesized ZnO Nanoparticles Using Albizia lebbeck Extract Induced Biochemical and Morphological Alterations in Wistar Rats
Authors: Kavaz Doga , Abubakar Amina Lawan , Rizaner Nahit , Umar Huzaifa
Published: June 2021

Nano-based particles synthesized via green routes have a particular structure that is useful in biomedical applications as they provide cheap, eco-friendly, and non-toxic nanoparticles. In the present study, we reported the effect of various concentrations of Zinc oxide nanoparticles synthesized using A. lebbeck stem bark extract (ZnO NPsAL) as stabilizing agent on rat biochemical profiles and tissue morphology. Adult Wistar rats weighing 170 ± 5 g were randomly classified into eight groups of five rats each; Group A served as a control fed with normal diet and water. Groups B1, B2, C1, C2, D1, D2, and E were treated with 40 mg/kg and 80 mg/kg of the 0.01, 0.05, and 0.1 M biosynthesized ZnO NPsAL and zinc nitrate daily by the gavage method, respectively. The rats were anesthetized 24 h after the last treatment, blood samples, kidney, heart, and liver tissues were collected for biochemical and histopathological analysis. The rats mean body weight, serum alkaline phosphatase, alanine aminotransferase, creatinine, urea, bilirubin, protein, albumin, globulin, total cholesterol, triacylglycerol, and high-density lipoprotein were significantly altered with an increased concentration of biosynthesized ZnO NPsAL when compared with the control group (p < 0.05; n ≥ 5). Furthermore, histopathological analysis of treated rats’ kidney, heart, and liver tissue revealed vascular congestion, tubular necrosis, inflammation, and cytoplasmic vacuolation. Biosynthesized ZnO NPsAL showed significant alteration in biochemical parameters and tissue morphology in rats with increasing concentrations of the nanoparticles.
Fermentative Production of Fructo-Oligosaccharides Using Aureobasidium pullulans: Effect of Dissolved Oxygen Concentration and Fermentation Mode
Authors: Liang Xinquan , Li Chenglin , Cao Weifeng , Cao Weilei , Shen Fei , Wan Yinhua
Published: June 2021

Fructo-oligosaccharides (FOS) are prebiotics with numerous health benefits. So far, the dissolved oxygen (DO) concentration control strategy for fermentative production of FOS is still unknown. In order to improve FOS production, the effects of DO concentration and fermentation mode on FOS using Aureobasidium pullulans were investigated in this study. The greatest FOS production (123.2 ± 6.2 g/L), with a yield of 61.6% ± 3.0% (g FOS/g sucrose), was obtained in batch culture under high DO concentration. Furthermore, repeated-batch culture revealed that enzyme production and FOS production were not closely associated with cell growth. By keeping the DO concentration above 5% in the repeated-batch culture, a maximum FOS concentration of 548.3 ± 37.4 g/L and yield of 68.6% ± 2.6% (g FOS/g sucrose) were obtained, which were 3.45% and 11.4% times higher than those obtained in the batch culture without DO control, respectively. Additionally, the ratios of 1-fructofuranosyl nystose (GF4) and 1,1,1,1-kestohexose (GF5) were 33.8% and 23.2%, respectively, in the product of repeated-batch culture, but these compounds were not detected in batch culture. Thus, it can be concluded that the DO concentration affects not only the yield of FOS but also the composition of FOS with different degrees of polymerization, which is the key factor in the fermentative production of FOS with a high polymerization degree.
Actinidia arguta Leaf as a Donor of Potentially Healthful Bioactive Compounds: Implications of Cultivar, Time of Sampling and Soil N Level
Authors: Stefaniak Jan , Łata Barbara
Published: June 2021

The aim of this study was to assess the enzymatic and non-enzymatic antioxidant status of kiwiberry (Actinidia arguta) leaf under different N regimes tested three times in field conditions during the 2015 growing season in two cultivars (‘Weiki’ and ‘Geneva’). Leaf total antioxidant capacity using ABTS, DPPH and FRAP tests was evaluated in the years 2015 to 2017, which experienced different weather conditions. Both cultivars exhibited a significant fall in leaf L-ascorbic acid (L-AA) and reduced glutathione (GSH) as well as global content of these compounds during the growing season, while total phenolic contents slightly (‘Weiki’) or significantly (‘Geneva’) increased. There was a large fluctuation in antioxidative enzyme activity during the season. The correlation between individual antioxidants and trolox equivalent antioxidant capacity (TEAC) depended on the plant development phase. The study revealed two peaks of an increase in TEAC at the start and end of the growing season. Leaf L-AA, global phenolics, APX, CAT and TEAC depended on the N level, but thiol compounds were not affected. Over the three years, TEAC decreased as soil N fertility increased, and the strength of the N effect was year dependent. The relationship between leaf N content and ABTS and FRAP tests was highly negative. The antioxidant properties of kiwiberry leaves were found to be closely related to the plant development phase and affected by soil N fertility.
Scaling Up the Production of Electrodeposited Nanowires: A Roadmap towards Applications
Authors: Fernández-González Claudia , Guzmán-Mínguez Jesús C. , Guedeja-Marrón Alejandra , García-Martín Eduardo , Foerster Michael , Niño Miguel Ángel , Aballe Lucía , Quesada Adrián , Pérez Lucas , Ruiz-Gómez Sandra
Published: June 2021

The use of metallic nanowires is mostly reduced to scientific areas where a small quantity of nanostructures are needed. In order to broaden the applicability of these nanomaterials, it is necessary to establish novel synthesis protocols that provide a larger amount of nanowires than the conventional laboratory fabrication processes at a more competitive cost. In this work, we propose several modifications to the conventional electrochemical synthesis of nanowires in order to increase the production with considerably reduced production time and cost. To that end, we use a soft anodization procedure of recycled aluminum at room temperature to produce the alumina templates, followed by galvanostatic growth of CoFe nanowires. We studied their morphology, composition and magnetic configuration, and found that their properties are very similar to those obtained by conventional methods.
Next Generation of SDN in Cloud-Fog for 5G and Beyond-Enabled Applications: Opportunities and Challenges
Authors: Ahvar Ehsan , Ahvar Shohreh , Raza Syed Mohsan , Manuel Sanchez Vilchez Jose , Lee Gyu Myoung
Published: June 2021

In recent years, the number of objects connected to the internet have significantly increased. Increasing the number of connected devices to the internet is transforming today’s Internet of Things (IoT) into massive IoT of the future. It is predicted that, in a few years, a high communication and computation capacity will be required to meet the demands of massive IoT devices and applications requiring data sharing and processing. 5G and beyond mobile networks are expected to fulfill a part of these requirements by providing a data rate of up to terabits per second. It will be a key enabler to support massive IoT and emerging mission critical applications with strict delay constraints. On the other hand, the next generation of software-defined networking (SDN) with emerging cloudrelated technologies (e.g., fog and edge computing) can play an important role in supporting and implementing the above-mentioned applications. This paper sets out the potential opportunities and important challenges that must be addressed in considering options for using SDN in hybrid cloud-fog systems to support 5G and beyond-enabled applications.
The Effects of Bergamot Polyphenolic Fraction, Cynara cardunculus, and Olea europea L. Extract on Doxorubicin-Induced Cardiotoxicity
Authors: Maiuolo Jessica , Bava Irene , Carresi Cristina , Gliozzi Micaela , Musolino Vincenzo , Scarano Federica , Nucera Saverio , Scicchitano Miriam , Bosco Francesca , Ruga Stefano , Caterina Zito Maria , Oppedisano Francesca , Macri Roberta , Tavernese Annamaria , Mollace Rocco , Mollace Vincenzo
Published: June 2021

Doxorubicin is an anthracycline that is commonly used as a chemotherapy drug due to its cytotoxic effects. The clinical use of doxorubicin is limited due to its known cardiotoxic effects. Treatment with anthracyclines causes heart failure in 15–17% of patients, resulting in mitochondrial dysfunction, the accumulation of reactive oxygen species, intracellular calcium dysregulation, the deterioration of the cardiomyocyte structure, and apoptotic cell death. Polyphenols have a wide range of beneficial properties, and particular importance is given to Bergamot Polyphenolic Fraction; Oleuropein, one of the main polyphenolic compounds of olive oil; and Cynara cardunculus extract. These natural compounds have particular beneficial characteristics, owing to their high polyphenol contents. Among these, their antioxidant and antoproliferative properties are the most important. The aim of this paper was to investigate the effects of these three plant derivatives using an in vitro model of cardiotoxicity induced by the treatment of rat embryonic cardiomyoblasts (H9c2) with doxorubicin. The biological mechanisms involved and the crosstalk existing between the mitochondria and the endoplasmic reticulum were examined. Bergamot Polyphenolic Fraction, Oleuropein, and Cynara cardunculus extract were able to decrease the damage induced by exposure to doxorubicin. In particular, these natural compounds were found to reduce cell mortality and oxidative damage, increase the lipid content, and decrease the concentration of calcium ions that escaped from the endoplasmic reticulum. In addition, the direct involvement of this cellular organelle was demonstrated by silencing the ATF6 arm of the Unfolded Protein Response, which was activated after treatment with doxorubicin.
Role of Herbal Teas in Regulating Cellular Homeostasis and Autophagy and Their Implications in Regulating Overall Health
Authors: Brimson James Michael , Prasanth Mani Iyer , Malar Dicson Sheeja , Sharika Rajasekharan , Sivamaruthi Bhagavathi Sundaram , Kesika Periyanaina , Chaiyasut Chaiyavat , Tencomnao Tewin , Prasansuklab Anchalee
Published: June 2021

Tea is one of the most popular and widely consumed beverages worldwide, and possesses numerous potential health benefits. Herbal teas are well-known to contain an abundance of polyphenol antioxidants and other ingredients, thereby implicating protection and treatment against various ailments, and maintaining overall health in humans, although their mechanisms of action have not yet been fully identified. Autophagy is a conserved mechanism present in organisms that maintains basal cellular homeostasis and is essential in mediating the pathogenesis of several diseases, including cancer, type II diabetes, obesity, and Alzheimer’s disease. The increasing prevalence of these diseases, which could be attributed to the imbalance in the level of autophagy, presents a considerable challenge in the healthcare industry. Natural medicine stands as an effective, safe, and economical alternative in balancing autophagy and maintaining homeostasis. Tea is a part of the diet for many people, and it could mediate autophagy as well. Here, we aim to provide an updated overview of popular herbal teas’ health-promoting and disease healing properties and in-depth information on their relation to autophagy and its related signaling molecules. The present review sheds more light on the significance of herbal teas in regulating autophagy, thereby improving overall health.
Correction: Sugasini et al. Efficient Enrichment of Retinal DHA with Dietary Lysophosphatidylcholine-DHA: Potential Application for Retinopathies. Nutrients 2020, 12, 3114
Authors: Sugasini Dhavamani , Yalagala Poorna , Subbaiah Papasani
Published: June 2021

The authors wish to make the following corrections to their recently published paper [...]
Magnesium Deficiency Alters Expression of Genes Critical for Muscle Magnesium Homeostasis and Physiology in Mice
Authors: Bayle Dominique , Coudy-Gandilhon Cécile , Gueugneau Marine , Castiglioni Sara , Zocchi Monica , Maj-Zurawska Magdalena , Palinska-Saadi Adriana , Mazur André , Béchet Daniel , Maier Jeanette A.
Published: June 2021

Chronic Mg2+ deficiency is the underlying cause of a broad range of health dysfunctions. As 25% of body Mg2+ is located in the skeletal muscle, Mg2+ transport and homeostasis systems (MgTHs) in the muscle are critical for whole-body Mg2+ homeostasis. In the present study, we assessed whether Mg2+ deficiency alters muscle fiber characteristics and major pathways regulating muscle physiology. C57BL/6J mice received either a control, mildly, or severely Mg2+-deficient diet (0.1%; 0.01%; and 0.003% Mg2+ wt/wt, respectively) for 14 days. Mg2+ deficiency slightly decreased body weight gain and muscle Mg2+ concentrations but was not associated with detectable variations in gastrocnemius muscle weight, fiber morphometry, and capillarization. Nonetheless, muscles exhibited decreased expression of several MgTHs (MagT1, CNNM2, CNNM4, and TRPM6). Moreover, TaqMan low-density array (TLDA) analyses further revealed that, before the emergence of major muscle dysfunctions, even a mild Mg2+ deficiency was sufficient to alter the expression of genes critical for muscle physiology, including energy metabolism, muscle regeneration, proteostasis, mitochondrial dynamics, and excitation–contraction coupling.
Effects of a 2-Week 5000 IU versus 1000 IU Vitamin D3 Supplementation on Recovery of Symptoms in Patients with Mild to Moderate Covid-19: A Randomized Clinical Trial
Authors: Sabico Shaun , Enani Mushira A. , Sheshah Eman , Aljohani Naji J. , Aldisi Dara A. , Alotaibi Naif H. , Alshingetti Naemah , Alomar Suliman Y. , Alnaami Abdullah M. , Amer Osama E. , Hussain Syed D. , Al-Daghri Nasser M.
Published: June 2021

Objective: Vitamin D deficiency has been associated with an increased risk of COVID-19 severity. This multi-center randomized clinical trial aims to determine the effects of 5000 IU versus 1000 IU daily oral vitamin D3 supplementation in the recovery of symptoms and other clinical parameters among mild to moderate COVID-19 patients with sub-optimal vitamin D status. Study Design and Setting: A total of 69 reverse transcriptase polymerase chain reaction (RT-PCR) SARS-CoV-2 positive adults who were hospitalized for mild to moderate COVID-19 disease were allocated to receive once daily for 2 weeks either 5000 IU oral vitamin D3 (n = 36, 21 males; 15 females) or 1000 IU oral vitamin D3 (standard control) (n = 33, 13 males; 20 females). Anthropometrics were measured and blood samples were taken pre- and post-supplementation. Fasting blood glucose, lipids, serum 25(OH)D, and inflammatory markers were measured. COVID-19 symptoms were noted on admission and monitored until full recovery. Results: Vitamin D supplementation for 2 weeks caused a significant increase in serum 25(OH)D levels in the 5000 IU group only (adjusted p = 0.003). Within-group comparisons also showed a significant decrease in BMI and IL-6 levels overtime in both groups (p-values < 0.05) but was not clinically significant in between-group comparisons. Kaplan–Meier survival analysis revealed that the 5000 IU group had a significantly shorter time to recovery (days) than the 1000 IU group in resolving cough, even after adjusting for age, sex, baseline BMI, and D-dimer (6.2 ± 0.8 versus 9.1 ± 0.8; p = 0.039), and ageusia (loss of taste) (11.4 ± 1.0 versus 16.9 ± 1.7; p = 0.035). Conclusion: A 5000 IU daily oral vitamin D3 supplementation for 2 weeks reduces the time to recovery for cough and gustatory sensory loss among patients with sub-optimal vitamin D status and mild to moderate COVID-19 symptoms. The use of 5000 IU vitamin D3 as an adjuvant therapy for COVID-19 patients with suboptimal vitamin D status, even for a short duration, is recommended.