bluuebunny/crossref_metadata_2025 huggingface dataset:
LC-HRMS/MS-Based Metabolomics Approaches Applied to the Detection of Antifungal Compounds and a Metabolic Dynamic Assessment of Orchidaceae
Authors: Lima Gesiane S. , Lima Nerilson M. , Roque Jussara V. , de Aguiar Deborah V. A. , Oliveira João V. A. , dos Santos Gabriel F. , Chaves Andrea R. , Vaz Boniek G.
Published: November 2022

The liquid chromatography–mass spectrometry (LC-MS)-based metabolomics approach is a powerful technology for discovering novel biologically active molecules. In this study, we investigated the metabolic profiling of Orchidaceae species using LC-HRMS/MS data combined with chemometric methods and dereplication tools to discover antifungal compounds. We analyze twenty ethanolic plant extracts from Vanda and Cattleya (Orchidaceae) genera. Molecular networking and chemometric methods were used to discriminate ions that differentiate healthy and fungal-infected plant samples. Fifty-three metabolites were rapidly annotated through spectral library matching and in silico fragmentation tools. The metabolomic profiling showed a large production of polyphenols, including flavonoids, phenolic acids, chromones, stilbenoids, and tannins, which varied in relative abundance across species. Considering the presence and abundance of metabolites in both groups of samples, we can infer that these constituents are associated with biochemical responses to microbial attacks. In addition, we evaluated the metabolic dynamic through the synthesis of stilbenoids in fungal-infected plants. The tricin derivative flavonoid- and the loliolide terpenoidfound only in healthy plant samples, are promising antifungal metabolites. LC-HRMS/MS, combined with state-of-the-art tools, proved to be a rapid and reliable technique for fingerprinting medicinal plants and discovering new hits and leads.
Extraction of Hydroxyapatite from Camel Bone for Bone Tissue Engineering Application
Authors: Khurshid Zohaib , Alfarhan Mohammed Farhan , Mazher Javed , Bayan Yasmin , Cooper Paul R. , Dias George J. , Adanir Necdet , Ratnayake Jithendra
Published: November 2022

Waste tissues such as mammalian bone are a valuable source from which to extract hydroxyapatite. Camel bone-based hydroxyapatite (CBHA) was extracted from the femur of camel bones using a defatting and deproteinization procedure. The extracted CBHA was mechanically, chemically, physically, morphologically and structurally characterized. Fourier-Transform Infra-Red (FTIR) spectra, Micro-Raman, and X-ray diffraction analysis confirmed successful extraction of hydroxyapatite. The mechanical properties of the CBHA scaffold were measured using a Universal Instron compression tester. Scanning electron microscopy showed the presence of a characteristic interconnected porous architecture with pore diameter ranging from 50–600 µm and micro-computer tomography (Micro-CT) analysis identified a mean porosity of 73.93. Thermogravimetric analysis showed that the CBHA was stable up to 1000 °C and lost only 1.435% of its weight. Inductively coupled plasma–mass spectrometry (ICP-MS) and Energy-dispersive-X-ray (EDX) analysis demonstrated the presence of significant amounts of calcium and phosphorus and trace ions of sodium, magnesium, zinc, lead and strontium. Following 21 days of incubation in simulated body fluid (SBF), the pH fluctuated between 10–10.45 and a gradual increase in weight loss was observed. In conclusion, the extracted CBHA is a promising material for future use in bone tissue regeneration applications.
Interfacial Interaction of Clay and Saturates in Petroleum-Contaminated Soil: Effect of Clay Surface Heterogeneity
Authors: Yang Yang , Liang Xing , Li Xiaobing
Published: November 2022

Petroleum-contaminated soil (PCS) exhibits a variety of oil–soil interfacial properties. Surface heterogeneity of soil particles is one of the most critical influencing aspects. The interaction energies of the heterogeneous surfaces of montmorillonite (Mnt) and kaolinite (Kln) for saturates adsorption were determined by molecular simulation to be −1698.88 ± 0.67 (001 surface of Mnt), −73.81 ± 0.51 (010 edge of Mnt), −3086.33 ± 0.46 (001 surface of Kln), and −850.17 ± 0.74 (010 edge of Kln) kJ/mol, respectively. The adsorption of both clays with saturates relied on van der Waals forces, and the edges of Mnt were hardly adsorbed with saturates. According to adhesive force measurements, the oil–clay interaction forces of Mnt and Kln were 111.18 ± 0.01 and 122.65 ± 0.03 μN, respectively. In agreement with the simulations, Kln adsorbed saturates more strongly. Dynamic interfacial rheology and liquid viscoelasticity also revealed differences in adsorption behaviors between Mnt–saturates and Kln–saturates. It demonstrated that in the case of relatively low clay concentrations, the impact of particle surface heterogeneity on the adsorption process was stronger than that of structure even though Mnt had multilayer structures. Moreover, in thermodynamic adsorption experiments, it was evident that Kln adsorbed more oil than Mnt at the adsorption equilibrium states even though both were multilayer adsorptions and the adsorption amounts declined with increasing temperature. Simultaneously, the characteristics of the thermal adsorption of clay and saturates with different proportions were consistent with clay dispersion in saturates, and Kln released more heat being combined with oil. Overall, the heterogeneity of clay particles strongly affects the oil–clay interfacial chemical behaviors, causing more difficulty in treating PCS containing Kln than those containing Mnt. These results provide a theoretical basis for PCS treatment technology.
Metal-Oxide FET Biosensor for Point-of-Care Testing: Overview and Perspective
Authors: Amen Mohamed Taha , Pham Thuy Thi Thanh , Cheah Edward , Tran Duy Phu , Thierry Benjamin
Published: November 2022

Metal-oxide semiconducting materials are promising for building high-performance field-effect transistor (FET) based biochemical sensors. The existence of well-established top-down scalable manufacturing processes enables the reliable production of cost-effective yet high-performance sensors, two key considerations toward the translation of such devices in real-life applications. Metal-oxide semiconductor FET biochemical sensors are especially well-suited to the development of Point-of-Care testing (PoCT) devices, as illustrated by the rapidly growing body of reports in the field. Yet, metal-oxide semiconductor FET sensors remain confined to date, mainly in academia. Toward accelerating the real-life translation of this exciting technology, we review the current literature and discuss the critical features underpinning the successful development of metal-oxide semiconductor FET-based PoCT devices that meet the stringent performance, manufacturing, and regulatory requirements of PoCT.
Eye-Resolvable Surface-Plasmon-Enhanced Fluorescence Temperature Sensor
Authors: Tang Luping , Zhang Yangyang , Liao Chen , He Longbing , Wu Xing , Liu Yiwei , Sun Litao
Published: November 2022

Temperature sensors are widely used in important fields such as daily home, medical care, and aerospace as a commonly used device for measuring temperature. Traditional temperature sensors such as thermocouples, thermal resistances, and infrared sensors are technically mature; however, they have limitations in the application environment, temperature measurement range, and temperature measurement accuracy. An eye-resolvable surface plasmon-enhanced fluorescence temperature sensor based on dual-emission Ag@SiO2@CdS/ZnS composite nanoparticle film with multiple-parameter detectable signals and high response sensitivity was proposed in this work. The temperature sensor’s x-chromaticity coordinate varied from 0.299 to 0.358 in the range of 77–297 K, while the y-chromaticity coordinate varied from 0.288 to 0.440, displaying eye-resolvable surface plasmon-enhanced fluorescence. The ratiometric response of two isolated photoluminescence (PL) peak-integrated areas located around 446 and 592 nm was found to be significantly temperature dependent, with a thermal sensitivity of 1.4% K−1, which can be used as an additional parameter to measure the precise temperature. Furthermore, the surface state emission peak intensity was linearly related to temperature, with a correlation index Adj. R-Square of 99.8%. Multiple independent temperature estimates can help with self-calibration and improve the measurement accuracy. Our findings show that the designed sensors can detect low temperatures while maintaining stability and reproducibility.
A Simple Doping Process Achieved by Modifying the Passivation Layer for Self-Aligned Top-Gate In-Ga-Zn-O Thin-Film Transistors at 200 °C
Authors: Peng Cong , Huang Huixue , Xu Meng , Chen Longlong , Li Xifeng , Zhang Jianhua
Published: November 2022

In this paper, a facile modifying technique of source/drain regions conductivity was proposed for self-aligned top-gate In-Ga-Zn-O (IGZO) thin-film transistors (TFTs) by controlling the process parameter of the passivation layer at relatively low temperatures. The sheet resistance of the source and drain regions of IGZO was approximately 365 Ω/□, and there was no significant change within a month. The device parameters of mobility, threshold voltage, subthreshold swing, and current switching ratio of the fabricated device were 15.15 cm2V−1s−1, 0.09 V, 0.15 V/dec, and higher than 109, respectively. The threshold voltage drift under negative bias illumination stress was −0.34 V. In addition, a lower channel width-normalized contact resistance of 9.86 Ω·cm was obtained.
Highly Bright Gold Nanowires Arrays for Sensitive Detection of Urea and Urease
Authors: Li Yan , Zhao Aowei , Wang Jieqiong , Yu Jieyu , Xiao Fei , Sun Hongcheng
Published: November 2022

In this work, highly fluorescent gold nanowire arrays (Au NWs) are successfully synthesized by assembling Zn2+ ions and non-emissive oligomeric gold-thiolate clusters using mercaptopropionic acid both as a reducing agent and a growth ligand. The synthesized Au NWs exhibited strong bluish green fluorescence with an absolute quantum yield up to 32% and possessed ultrasensitive pH stimuli-responsive performance in the range of 7.0–7.8. Based on the excellent properties of the as-prepared nanowire arrays, we developed a facile, sensitive, and selective fluorescent method for quantitative detection of urea and urease. The fabricated nanoprobe showed superior biosensing response characteristics with good linearities in the range of 0–100 μM for urea concentration and 0–12 U/L for urease activity. In addition, this fluorescent probe afforded relatively high sensitivity with the detection limit as low as 2.1 μM and 0.13 U/L for urea and urease, respectively. Urea in human urine and urease in human serum were detected with satisfied results, exhibiting a promising potential for biomedical application.
Effects of Hall Current and Viscous Dissipation on Bioconvection Transport of Nanofluid over a Rotating Disk with Motile Microorganisms
Authors: Alzahrani Abdullah K.
Published: November 2022

The study of rotating-disk heat-flow problems is relevant to computer storage devices, rotating machineries, heat-storage devices, MHD rotators, lubrication, and food-processing devices. Therefore, this study investigated the effects of a Hall current and motile microorganisms on nanofluid flow generated by the spinning of a disk under multiple slip and thermal radiation conditions. The Buongiorno model of a nonhomogeneous nanofluid under Brownian diffusion and thermophoresis was applied. Using the Taylor series, the effect of Resseland radiation was linearized and included in the energy equation. By implementing the appropriate transformations, the governing partial differential equations (PDEs) were simplified into a two-point ordinary boundary value problem. The classical Runge–Kutta dependent shooting method was used to find the numerical solutions, which were validated using the data available in the literature. The velocity, motile microorganism distribution, temperature, and concentration of nanoparticles were plotted and comprehensively analyzed. Moreover, the density number, Sherwood number, shear stresses, and Nusselt number were calculated. The radial and tangential velocity declined with varying values of magnetic numbers, while the concentration of nanoparticles, motile microorganism distribution, and temperature increased. There was a significant reduction in heat transfer, velocities, and motile microorganism distribution under the multiple slip conditions. The Hall current magnified the velocities and reduced the heat transfer. Thermal radiation improved the Nusselt number, while the thermal slip conditions reduced the Nusselt number.
A High-Quality CdSe/CdS/ZnS Quantum-Dot-Based FRET Aptasensor for the Simultaneous Detection of Two Different Alzheimer’s Disease Core Biomarkers
Authors: Lu Xingchang , Hou Xiaoqi , Tang Hailin , Yi Xinyao , Wang Jianxiu
Published: November 2022

The simultaneous detection of two different biomarkers for the point-of-care diagnosis of major diseases, such as Alzheimer’s disease (AD), is greatly challenging. Due to the outstanding photoluminescence (PL) properties of quantum dots (QDs), a high-quality CdSe/CdS/ZnS QD-based fluorescence resonance energy transfer (FRET) aptasensor for simultaneously monitoring the amyloid-β oligomers (AβO) and tau protein was proposed. By engineering the interior inorganic structure and inorganic–organic interface, water-soluble dual-color CdSe/CdS/ZnS QDs with a near-unity PL quantum yield (>90%) and mono-exponential PL decay dynamics were generated. The π–π stacking and hydrogen bond interaction between the aptamer-functionalized dual-color QDs and gold nanorods@polydopamine (Au NRs@PDA) nanoparticles resulted in significant fluorescence quenching of the QDs through FRET. Upon the incorporation of the AβO and tau protein, the fluorescence recovery of the QDs-DNA/Au NRs@PDA assembly was attained, providing the possibility of simultaneously assaying the two types of AD core biomarkers. The lower detection limits of 50 pM for AβO and 20 pM for the tau protein could be ascribed to the distinguishable and robust fluorescence of QDs and broad spectral absorption of Au NRs@PDA. The sensing strategy serves as a viable platform for the simultaneously monitoring of the core biomarkers for AD and other major diseases.
Nanosecond Laser-Textured Copper Surfaces Hydrophobized with Self-Assembled Monolayers for Enhanced Pool Boiling Heat Transfer
Authors: Može Matic , Zupančič Matevž , Steinbücher Miha , Golobič Iztok , Gjerkeš Henrik
Published: November 2022

Increased cooling requirements of many compact systems involving high heat fluxes demand the development of high-performance cooling techniques including immersion cooling utilizing pool boiling. This study presents the functionalization of copper surfaces to create interfaces for enhanced pool boiling heat transfer. Three types of surface structures including a crosshatch pattern, shallow channels and deep channels were developed using nanosecond laser texturing to modify the surface micro- and nanomorphology. Each type of surface structure was tested in the as-prepared superhydrophilic state and superhydrophobic state following hydrophobization, achieved through the application of a nanoscale self-assembled monolayer of a fluorinated silane. Boiling performance evaluation was conducted through three consecutive runs under saturated conditions at atmospheric pressure utilizing water as the coolant. All functionalized surfaces exhibited enhanced boiling heat transfer performance in comparison with an untreated reference. The highest critical heat flux of 1697 kW m−2 was achieved on the hydrophobized surface with shallow channels. The highest heat transfer coefficient of 291.4 kW m−2 K−1 was recorded on the hydrophobized surface with deep channels at CHF incipience, which represents a 775% enhancement over the highest values recorded on the untreated reference. Surface microstructure was identified as the key reason for enhanced heat transfer parameters. Despite large differences in surface wettability, hydrophobized surfaces exhibited comparable (or even higher) CHF values in comparison with their hydrophilic counterparts, which are traditionally considered as more favorable for achieving high CHF values. A significant reduction in bubble departure diameter was observed on the hydrophobized surface with deep channels and is attributed to effective vapor entrapment, which is pointed out as a major contributing reason behind the observed extreme boiling heat transfer performance.
NiO-Based Aerogels—Unexpected Formation of Metallic Nickel Nanoparticles during Supercritical Drying Process
Authors: Straumal Elena A. , Mazilkin Andrey A. , Gozhikova Inna O. , Yurkova Lyudmila L. , Kottsov Sergey Yu. , Lermontov Sergey A.
Published: November 2022

The aim of the study is to investigate the influence of the solvents applied both in sol–gel process and for supercritical drying (SCD) on NiO aerogels’ properties. NiO aerogels were synthesized using methanol and 2-methoxy-ethanol (MeGl) as sol solvents. SCD was performed using iso-propanol, methanol and tert-butyl-methyl ether as supercritical fluids. The obtained samples were characterized using low-temperature nitrogen adsorption, X-ray diffraction analysis, mass-spectra analysis and STEM and TEM methods. It was found that specific surface area and the phase and chemical composition strongly depend on the synthesis conditions. We revealed that Ni2+ cations were reduced into Ni0 when 2-methoxy-ethanol was applied as a sol solvent. The mechanism of the Ni2+ cations reduction is proposed. We consider that at the stage of sol preparation, the Ni2+–MeGl chelate was formed. This chelate decomposes at the SCD stage with the release of MeGl, which, in turn, eliminates methanol and leads to the formation of aldehyde. The latter is responsible for the nickel reduction. The proposed mechanism was confirmed experimentally.
Humoral Response to SARS-CoV-2 Antigen in Patients Treated with Monoclonal Anti-CD20 Antibodies: It Is Not All about B Cell Recovery
Authors: Feige Julia , Berek Klaus , Seiberl Michael , Hilpold Patrick , Hitzl Wolfgang , Di Pauli Franziska , Hegen Harald , Deisenhammer Florian , Trinka Eugen , Harrer Andrea , Wipfler Peter , Moser Tobias
Published: November 2022

Anti-CD20 therapies decrease the humoral response to SARS-CoV-2 immunization. We aimed to determine the extent of the humoral response to SARS-CoV-2 antigens in correlation with peripheral B-cell dynamics among patients with central nervous system inflammatory disorders treated with anti-CD20 medications. We retrospectively included patients receiving anti-CD20 therapy after antigen contact who were divided into responders (>7 binding antibody units (BAU)/mL) and non-responders (<7 BAU/mL). In participants with first antigen contact prior to therapy, we investigated the recall response elicited once under treatment. We included 80 patients (responders n = 34, non-responders n = 37, recall cohort n = 9). The B-cell counts among responders were significantly higher compared to non-responders (mean 1012 cells/µL ± SD 105 vs. mean 17 cells/µL ± SD 47; p < 0.001). Despite very low B-cell counts (mean 9 cells/µL ± SD 20), humoral response was preserved among the recall cohort (mean 1653 BAU/mL ± SD 2250.1) and did not differ significantly from responders (mean 735 BAU/mL ± SD 1529.9; p = 0.14). Our data suggest that peripheral B cells are required to generate antibodies to neo-antigens but not for a recall response during anti-CD20 therapy. Evaluation of B-cell counts and pre-existing SARS-CoV-2 antibodies might serve as biomarkers for estimating the immune competence to mount a humoral response to SARS-CoV-2 antigens.
Vitamin A Concentration in Human Milk: A Meta-Analysis
Authors: Zhang Huanmei , Ren Xiangnan , Yang Zhenyu , Lai Jianqiang
Published: November 2022

Humans require vitamin A (VA). However, pooled VA data in human milk is uncommon internationally and offers little support for dietary reference intake (DRIs) revision of infants under 6 months. As a result, we conducted a literature review and a meta-analysis to study VA concentration in breast milk throughout lactation across seven databases by August 2021. Observational or intervention studies involving nursing mothers between the ages of 18 and 45, with no recognized health concerns and who had full-term infants under 48 months were included. Studies in which retinol concentration was expressed as a mass concentration on a volume basis and determined using high-, ultra-, or ultra-fast performance liquid chromatography (HPLC, UPLC, or UFLC) were chosen. Finally, 76 papers involving 9171 samples published between 1985 and 2021 qualified for quantitative synthesis. Results from the random-effects model showed that the VA concentration of healthy term human milk decreased significantly as lactation progressed. VA (µg/L) with 95% CI at the colostrum, transitional, early mature and late mature stages being 920.7 (744.5, 1095.8), 523.7 (313.7, 733.6), 402.4 (342.5, 462.3) and 254.7 (223.7, 285.7), respectively (X2 = 71.36, p < 0.01). Subgroup analysis revealed no significant differences identified in VA concentration (µg/L) between Chinese and non-Chinese samples at each stage, being 1039.1 vs. 895.8 (p = 0.64), 505.7 vs. 542.2(p = 0.88), 408.4 vs. 401.2 (p = 0.92), 240.0 vs. 259.3 (p = 0.41). The findings have significant implications for the revision of DRIs for infants under six months.
New BMI Cut-Off Points for Obesity in Middle-Aged and Older Adults in Clinical Nutrition Settings in Italy: A Cross-Sectional Study
Authors: Di Renzo Laura , Itani Leila , Gualtieri Paola , Pellegrini Massimo , El Ghoch Marwan , De Lorenzo Antonino
Published: November 2022

Obesity is a major health problem defined as an excess accumulation of body fat (BF). The World Health Organization (WHO) usually relies on a body mass index (BMI) ≥ 30 kg/m2 as an indicator of obesity. Due to changes in body composition that occur across the lifespan, with an increase in BF and a decrease in lean mass, we aimed to test the validity of this BMI cut-off point for adiposity in middle-aged and older adults. This cross-sectional study, composed of 4800 adults of mixed gender aged between 40 and 80 years, included (according to the WHO BMI classification) 1087 normal-weight, 1826 overweight, and 1887 obese individuals who were referred to the Department of Biomedicine and Prevention, University of Rome “Tor Vergata”, Italy. The sample was then categorized by adiposity status based on the total BF% as measured by dual-energy X-ray absorptiometry (DXA), and the best sensitivity and specificity were attained for predicting obesity according to the receiver operating characteristic curve (ROC) analysis. In a real-world clinical setting, a new BMI cut-off point (BMI = 27.27 kg/m2) has been identified for predicting obesity in middle-aged and older adults. Obesity guidelines in Italy therefore need to be revised accordingly.
Impact of Energy and Protein Delivery to Critically Ill Patients: A Systematic Review and Meta-Analysis of Randomized Controlled Trials
Authors: Nakanishi Nobuto , Matsushima Shinya , Tatsuno Junko , Liu Keibun , Tamura Takahiko , Yonekura Hiroshi , Yamamoto Norimasa , Unoki Takeshi , Kondo Yutaka , Nakamura Kensuke
Published: November 2022

Optimal energy and protein delivery goals for critically ill patients remain unknown. The purpose of this systematic review and meta-analysis was to compare the impact of energy and protein delivery during the first 4 to 10 days of an ICU stay on physical impairments. We performed a systematic literature search of MEDLINE, CENTRAL, and ICHUSHI to identify randomized controlled trials (RCTs) that compared energy delivery at a cut-off of 20 kcal/kg/day or 70% of estimated energy expenditure or protein delivery at 1 g/kg/day achieved within 4 to 10 days after admission to the ICU. The primary outcome was activities of daily living (ADL). Secondary outcomes were physical functions, changes in muscle mass, quality of life, mortality, length of hospital stay, and adverse events. Fifteen RCTs on energy delivery and 14 on protein were included in the analysis. No significant differences were observed in any of the outcomes included for energy delivery. However, regarding protein delivery, there was a slight improvement in ADL (odds ratio 21.55, 95% confidence interval (CI) −1.30 to 44.40, p = 0.06) and significantly attenuated muscle loss (mean difference 0.47, 95% CI 0.24 to 0.71, p < 0.0001). Limited numbers of RCTs were available to analyze the effects of physical impairments. In contrast to energy delivery, protein delivery ≥1 g/kg/day achieved within 4 to 10 days after admission to the ICU significantly attenuated muscle loss and slightly improved ADL in critically ill patients. Further RCTs are needed to investigate their effects on physical impairments.
Effect of Lactobacillus rhamnosus hsryfm 1301 Fermented Milk on Lipid Metabolism Disorders in High-Fat-Diet Rats
Authors: Qu Hengxian , Zong Lina , Sang Jian , Wa Yunchao , Chen Dawei , Huang Yujun , Chen Xia , Gu Ruixia
Published: November 2022

To further explore and improve the mechanism of probiotics to alleviate the disorder of lipid metabolism, transcriptomic and metabolomic with bioinformatic analysis were combined. In the present study, we successfully established a rat model of lipid metabolism disorder using a high-fat diet. Intervention with Lactobacillus rhamnosus hsryfm 1301 fermented milk resulted in a significant reduction in body weight, serum free fatty acid and blood lipid levels (p < 0.05), which predicted that the lipid metabolism disorder was alleviated in rats. Metabolomics and transcriptomics identified a total of 33 significantly different metabolites and 183 significantly different genes screened in the intervention group compared to the model group. Comparative analysis of Kyoto Encyclopedia of Genes and Genomes (KEGG) pathway annotations identified a total of 61 pathways in which differential metabolites and genes were jointly involved, with linoleic acid metabolism, glycine, serine and threonine metabolism and glutamatergic synapse in both transcriptome and metabolome being found to be significantly altered (p < 0.05). Lactobacillus rhamnosus hsryfm 1301 fermented milk was able to directly regulate lipid metabolism disorders by regulating the metabolic pathways of linoleic acid metabolism, glycerophospholipid metabolism, fatty acid biosynthesis, alpha-linolenic acid metabolism, fatty acid degradation, glycerolipid metabolism and arachidonic acid metabolism. In addition, we found that Lactobacillus rhamnosus hsryfm 1301 fermented milk indirectly regulates lipid metabolism through regulating amino acid metabolism, the nervous system, the endocrine system and other pathways. Lactobacillus rhamnosus hsryfm 1301 fermented milk could alleviate the disorders of lipid metabolism caused by high-fat diet through multi-target synergy.
Comment on Budryn et al. Hydroxybenzoic Acids as Acetylcholinesterase Inhibitors: Calorimetric and Docking Simulation Studies. Nutrients 2022, 14, 2476
Authors: Zarguan Ilham , Benjouad Abdelaziz , Belayachi Lamiae
Published: November 2022

It is with great interest that we read the article entitled “Hydroxybenzoic Acids as Acetylcholinesterase Inhibitors: Calorimetric and Docking Simulation Studies” published in Nutrients 2022, 14, 2476 [...]
Reply to Zarguan et al. Comment on “Budryn et al. Hydroxybenzoic Acids as Acetylcholinesterase Inhibitors: Calorimetric and Docking Simulation Studies. Nutrients 2022, 14, 2476”
Authors: Grzelczyk Joanna , Budryn Grażyna , Pérez-Sánchez Horacio
Published: November 2022

We thank Prof. Zarguan’s group for their comment [...]
In Vitro Photodynamic Treatment Modality for A375 Melanoma Cell Line Using a Sulphonated Aluminum Phthalocyanine Chloride-Photosensitizer-Gold Nanoparticle Conjugate
Authors: Mkhobongo Bridgette , Chandran Rahul , Abrahamse Heidi
Published: November 2022

Metastatic melanoma cancer stem cells are subpopulations that have been identified and linked to tumor progression, immunoevasive behavior, drug resistance, and metastasis, leading to a poor prognosis. Photodynamic therapy (PDT) is an approach to eradicate cancer through a photochemical process which directly generates reactive oxygen species (ROS). This study investigated the impact of PDT using an aluminum phthalocyanine gold nanoparticle (AlPcS4Cl-AuNP) conjugate for targeting melanoma stem cells. The isolated stem cells were irradiated at 673.2 nm with a radiant exposure of 5 J/cm2. Post-irradiation signs of cell death were determined using microscopy and biochemical assays. A possible enhanced effect of ROS in inducing cell death could be seen when AlPcS4Cl was conjugated to AuNPs. Nanoparticles as carriers promote the efficient cellular uptake of photosensitizers, enhancing organelle accumulation and the targeted therapy of cancerous cells. A biochemical assay revealed significant post-irradiation signs of cell death. The measurement of adenosine triphosphate (ATP) content revealed a decrease in cell proliferation. The study suggested an approach directed at expanding the knowledge on PDT to improve cancer treatment. Understanding the cell death mechanism through which ROS influence cancer stem cells (CSCs) is, therefore, useful for improving PDT efficiency and preventing tumor recurrence and metastasis.
Selective Activation of the Wnt-Signaling Pathway as a Novel Therapy for the Treatment of Diabetic Retinopathy and Other Retinal Vascular Diseases
Authors: Nguyen Huy , Lee Sung-Jin , Li Yang
Published: November 2022

Retinal ischemia, often associated with various disorders such as diabetic retinopathy (DR), retinal vein occlusion, glaucoma, optic neuropathies, stroke, and other retinopathies, is a major cause of visual impairment and blindness worldwide. As proper blood supply to the retina is critical to maintain its high metabolic demand, any impediment to blood flow can lead to a decrease in oxygen supply, resulting in retinal ischemia. In the pathogenesis of DR, including diabetic macular edema (DME), elevated blood glucose leads to blood-retina barrier (BRB) disruptions, vascular leakage, and capillary occlusion and dropouts, causing insufficient delivery of oxygen to the retina, and ultimately resulting in visual impairment. Other potential causes of DR include neuronal dysfunction in the absence of vascular defect, genetic, and environmental factors. The exact disease progression remains unclear and varies from patient to patient. Vascular leakage leading to edema clearly links to visual impairment and remains an important target for therapy. Despite recent advances in the treatment of DME and DR with anti-VEGFs, effective therapies with new mechanisms of action to address current treatment limitations regarding vessel regeneration and reperfusion of ischemic retinal areas are still needed. The Wnt signaling pathway plays a critical role in proper vascular development and maintenance in the retina, and thus provides a novel therapeutic approach for the treatment of diabetic and other retinopathies. In this review, we summarize the potential of this pathway to address treatment gaps with current therapies, its promise as a novel and potentially disease modifying therapy for patients with DR and opportunities in other retinal vascular diseases.
Dehydroepiandrosterone Cocrystals with Improved Solubility and Bioavailability
Authors: Jiang Yihua , Cheng Yinxiang , Xia Mengyuan , Zhang Bingrui , Ding Qiaoce , Lu Liye , Wang Jian-Rong , Mei Xuefeng
Published: November 2022

Dehydroepiandrosterone (DHEA) is an FDA-approved food supplement used as an assisted reproductive sex hormone. The bioavailability is severely limited by its poor solubility (23 µg/mL). Herein, we aimed to modulate its solubility through cocrystallization. Eight cocrystals of DHEA with pyrocatechol (CAT), hydroquinone (HQ), resorcinol (RES), phloroglucinol (PG), 1,5-dihydroxy naphthalene (DHN), p-hydroxybenzoic acid (PHBA), gallic acid (GA), and 5-hydroxyisophthalic acid (5HIPA) were designed and synthesized. Some basic characterization tools, including powder X-ray diffraction, thermogravimetric analysis, differential scanning calorimetry, and Fourier transform infrared spectroscopy, were also applied in our work for basic analyses of cocrystals. It is indicated that DHEA-GA exhibits its superiority in dissolution and pharmacokinetic behaviors. While the area under the curve values of DHEA-GA is improved at the ratio of 2.2, the corresponding bioavailability of DHEA is expected to be accordingly increased.
Relevance of CYP2D6 Gene Variants in Population Genetic Differentiation
Authors: Stojanović Marković Anita , Zajc Petranović Matea , Škarić-Jurić Tatjana , Celinšćak Željka , Šetinc Maja , Tomas Željka , Peričić Salihović Marijana
Published: November 2022

A significant portion of the variability in complex features, such as drug response, is likely caused by human genetic diversity. One of the highly polymorphic pharmacogenes is CYP2D6, encoding an enzyme involved in the metabolism of about 25% of commonly prescribed drugs. In a directed search of the 1000 Genomes Phase III variation data, 86 single nucleotide polymorphisms (SNPs) in the CYP2D6 gene were extracted from the genotypes of 2504 individuals from 26 populations, and then used to reconstruct haplotypes. Analyses were performed using Haploview, Phase, and Arlequin softwares. Haplotype and nucleotide diversity were high in all populations, but highest in populations of African ancestry. Pairwise FST showed significant results for eleven SNPs, six of which were characteristic of African populations, while four SNPs were most common in East Asian populations. A principal component analysis of CYP2D6 haplotypes showed that African populations form one cluster, Asian populations form another cluster with East and South Asian populations separated, while European populations form the third cluster. Linkage disequilibrium showed that all African populations have three or more haplotype blocks within the CYP2D6 gene, while other world populations have one, except for Chinese Dai and Punjabi in Pakistan populations, which have two.
Preparation of Fluorescent Carbon Dots Composites and Their Potential Applications in Biomedicine and Drug Delivery—A Review
Authors: Chai Yaru , Feng Yashan , Zhang Kun , Li Jingan
Published: November 2022

Carbon dots (CDs), a new member of carbon nanostructures, rely on surface modification and functionalization for their good fluorescence phosphorescence and excellent physical and chemical properties, including small size (<10 nm), high chemical stability, biocompatibility, non-toxicity, low cost, and easy synthesis. In the field of medical research on cancer (IARC), CDs, a new material with unique optical properties as a photosensitizer, are being applied to heating local apoptosis induction of cancer cells. In addition, imaging tools can also be combined with a drug to form the nanometer complex compound, the imaging guidance for multi-function dosage, so as to improve the efficiency of drug delivery, which also plays a big role in genetic diagnosis. This paper mainly includes three parts: The first part briefly introduces the synthesis and preparation of carbon dots, and summarizes the advantages and disadvantages of different preparation methods; The second part introduces the preparation methods of carbon dot composites. Finally, the application status of carbon dot composites in biomedicine, cancer theranostics, drug delivery, electrochemistry, and photocatalysis is summarized.
Topical Semisolid Products—Understanding the Impact of Metamorphosis on Skin Penetration and Physicochemical Properties
Authors: Jin Xuping , Imran Mohammad , Mohammed Yousuf
Published: November 2022

Recently, the United States Food and Drug Administration published a series of product-specific guidance for the development of topical drugs, with in vitro options consisting of qualitative sameness (Q1) and quantitative sameness (Q2) assessment of formulations, physiochemical and structural characterization of formulations (Q3), and, potentially, in vitro drug release and permeation tests. In these tests, the topical semisolid product’s critical quality attributes (CQAs), such as rheological properties, thermodynamic activity, particle size, globule size, and rate/extent of drug release/permeation, are evaluated to ensure the desired product quality. However, alterations in these CQAs of the drug products may occur under ‘in use’ conditions because of various metamorphosis events, such as evaporation that leads to supersaturation and crystallization, which may eventually result in specific failure modes of semisolid products. Under ‘in use’ conditions, a limited amount of formulation is applied to the skin, where physicochemical characteristics of the formulation are substantially altered from primary state to secondary and, eventually, tertiary state on the skin. There is an urgent need to understand the behavior of topical semisolid products under ‘in use’ conditions. In this review, we attempt to cover a series of metamorphosis events and their impact on CQAs (Q3 attributes), such as viscosity, drug activity, particle size, globule size, and drug release/permeation of topical semisolid products.
Exploring the Potential of Alternate Inorganic Fibers for Automotive Composites
Authors: Shoaib Muhammad , Jamshaid Hafsa , Alshareef Mubark , Alharthi Fahad Ayesh , Ali Mumtaz , Waqas Muhammad
Published: November 2022

Composites are a promising material for high-specific strength applications; specifically, fiber-reinforced polymer composites (FRPCs) are in the limelight for their extraordinary mechanical properties. Amongst all FRPCs, carbon fiber reinforcements are dominant in the aerospace and automotive industry; however, their high cost poses a great obstacle in commercial-scale manufacturing. To this end, we explored alternate low-cost inorganic fibers such as basalt and rockwool as potential replacements for carbon fiber composites. In addition to fibrous inclusions to polymers, composites were also fabricated with inclusions of their respective particulates formed using ball milling of fibers. Considering automotive applications, composites’ mechanical and thermo-mechanical properties were compared for all samples. Regarding mechanical properties, rockwool fiber and basalt fiber composites showed 30.95% and 20.77% higher impact strength than carbon fiber, respectively. In addition, rockwool and basalt fiber composites are less stiff than carbon and can be used in low-end applications in the automotive industry. Moreover, rockwool and basalt fiber composites are more thermally stable than carbon fiber. Thermogravimetric analysis of carbon fiber composites showed 10.10 % and 9.98 % higher weight loss than basalt and rockwool fiber composites, respectively. Apart from better impact and thermal properties, the low cost of rockwool and basalt fibers provides a key advantage to these alternate fibers at the commercial scale.
Application of 3D-Woven Fabrics for Packaging Materials for Terminally Sterilized Medical Devices
Authors: Kovačević Stana , Rogina-Car Beti , Kiš Ana
Published: November 2022

This research aimed to test a newly developed 3D fabric for use in a hospital sterilization unit as a packaging material. Two basic properties were tested: the efficiency of the microbial barrier, and the bursting strength of the woven fabric, determined with a steel ball. Material deformations caused by bursting are common in medical sterilization, as a consequence of the packaging of the medical tools needed in surgery. Six 3D-fabric samples were woven from the same warp, with three weft densities and in two different weaves. The weaving conditions and other construction characteristics of the fabrics were the same. To determine the effectiveness of the microbial barrier, bacterial endospores of an apathogenic species of the genus Bacillus, Geobacillus stearothermophilus and Bacillus atrophaeus, were used. Mechanical testing of the 3D-woven fabric, i.e., the bursting strength of the fabric using a steel ball, was carried out according to the standard method. The results showed the exceptional puncture strength of the woven fabrics and their formation of an effective microbial barrier, i.e., complete impermeability to microorganisms in five samples, which is the main condition for possible use as a packaging material in medical sterilization. Sample 3tp did not provide an effective microbial barrier and did not meet the basic requirements for use in medical sterilization.
From Classical to Advanced Use of Polymers in Food and Beverage Applications
Authors: Vallejos Saúl , Trigo-López Miriam , Arnaiz Ana , Miguel Álvaro , Muñoz Asunción , Mendía Aránzazu , García José Miguel
Published: November 2022

Polymers are extensively used in food and beverage packaging to shield against contaminants and external damage due to their barrier properties, protecting the goods inside and reducing waste. However, current trends in polymers for food, water, and beverage applications are moving forward into the design and preparation of advanced polymers, which can act as active packaging, bearing active ingredients in their formulation, or controlling the head-space composition to extend the shelf-life of the goods inside. In addition, polymers can serve as sensory polymers to detect and indicate the presence of target species, including contaminants of food quality indicators, or even to remove or separate target species for later quantification. Polymers are nowadays essential materials for both food safety and the extension of food shelf-life, which are key goals of the food industry, and the irruption of smart materials is opening new opportunities for going even further in these goals. This review describes the state of the art following the last 10 years of research within the field of food and beverage polymer’s applications, covering present applications, perspectives, and concerns related to waste generation and the circular economy.
Effects of Heating Rate and Temperature on the Thermal Pyrolysis of Expanded Polystyrene Post-Industrial Waste
Authors: Gonzalez-Aguilar Arantxa M. , Cabrera-Madera Victoria P. , Vera-Rozo James R. , Riesco-Ávila José M.
Published: November 2022

The use of plastic as material in various applications has been essential in the evolution of the technology industry and human society since 1950. Therefore, their production and waste generation are high due to population growth. Pyrolysis is an effective recycling method for treating plastic waste because it can recover valuable products for the chemical and petrochemical industry. This work addresses the thermal pyrolysis of expanded polystyrene (EPS) post-industrial waste in a semi-batch reactor. The influence of reaction temperature (350–500 °C) and heating rate (4–40 °C min−1) on the liquid conversion yields and physicochemical properties was studied based on a multilevel factorial statistical analysis. In addition, the analysis of the obtaining of mono-aromatics such as styrene, toluene, benzene, ethylbenzene, and α-methyl styrene was performed. Hydrocarbon liquid yields of 76.5–93% were achieved at reaction temperatures between 350 and 450 °C, respectively. Styrene yields reached up to 72% at 450 °C and a heating rate of 25 °C min−1. Finally, the potential application of the products obtained is discussed by proposing the minimization of EPS waste via pyrolysis.
Environmentally Friendly Hybrid Organic–Inorganic Halogen-Free Coatings for Wood Fire-Retardant Applications
Authors: Lainioti Georgia C. , Koukoumtzis Vasilis , Andrikopoulos Konstantinos S. , Tsantaridis Lazaros , Östman Birgit , Voyiatzis George A. , Kallitsis Joannis K.
Published: November 2022

Wood and wood-based products are extensively used in the building sector due to their interesting combination of properties. Fire safety and fire spread, however, are of utmost concern for the protection of buildings. Therefore, in timber structures, wood must be treated with fire-retardant materials in order to improve its reaction to fire. This article highlights the flame retardancy of novel hybrid organic–inorganic halogen-free coatings applied on plywood substrates. For this purpose, either a huntite-rich mineral (H5) or its modified nano-Mg (OH)2 type form (H5-m), acting as an inorganic (nano) filler, was functionalized with reactive oligomers (ROs) and incorporated into a waterborne polymeric matrix. A water-soluble polymer (P (SSNa-co-GMAx)), combining its hydrophilic nature with functional epoxide groups, was used as the reactive oligomer in order to enhance the compatibility between the filler and the matrix. Among various coating compositions, the system composed of 13% polymeric matrix, 73% H5 and 14% ROs, which provided the best coating quality and flame retardancy, was selected for the coating of plywood on a larger scale in one or two layers. The results indicated that the novel plywood coating systems with the addition of ecological coating formulations (WF-13, WF-14 and WF-15), prepared at two layers, reached Euroclass B according to EN13501-1, which is the best possible for fire systems applied to wood.
Nanoparticles for Biomedical Application and Their Synthesis
Authors: Rezić Iva
Published: November 2022

Tremendous developments in nanotechnology have revolutionized the impact of nanoparticles (NPs) in the scientific community and, more recently, in society. Nanomaterials are by their definition materials that have at least one dimension in range of 1 to 100 nm. Nanoparticles are found in many types of different technological and scientific applications and innovations, from delicate electronics to state-of-the-art medical treatments. Medicine has recognized the importance of polymer materials coated with NPs and utilizes them widely thanks to their excellent physical, chemical, antibacterial, antimicrobial, and protective properties. Emphasis is given to their biomedical application, as the nanoscale structures are in the range of many biological molecules. Through this, they can achieve many important features such as targeted drug delivery, imaging, photo thermal therapy, and sensors. Moreover, by manipulating in a “nano-scale” range, their characteristic can be modified in order to obtain the desired properties needed in particular biomedical fields, such as electronic, optical, surface plasmon resonance, and physic-chemical features.