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34 pages, 30095 KiB  
Article
A Computational Method for the Binding Mode Prediction of COX-1 and COX-2 Inhibitors: Analyzing the Union of Coxibs, Oxicams, Propionic and Acetic Acids
Pharmaceuticals 2023, 16(12), 1688; https://doi.org/10.3390/ph16121688 (registering DOI) - 04 Dec 2023
Abstract
Among the biological targets extensively investigated to improve inflammation and chronic inflammatory conditions, cyclooxygenase enzymes (COXs) occupy a prominent position. The inhibition of these enzymes, essential for mitigating inflammatory processes, is chiefly achieved through Non-Steroidal Anti-Inflammatory Drugs (NSAIDs). In this work, we introduce [...] Read more.
Among the biological targets extensively investigated to improve inflammation and chronic inflammatory conditions, cyclooxygenase enzymes (COXs) occupy a prominent position. The inhibition of these enzymes, essential for mitigating inflammatory processes, is chiefly achieved through Non-Steroidal Anti-Inflammatory Drugs (NSAIDs). In this work, we introduce a novel method—based on computational molecular docking—that could aid in the structure-based design of new compounds or the description of the anti-inflammatory activity of already-tested compounds. For this, we used eight crystal complexes (four COX-1 and COX-2 each), and each pair had a specific NSAID: Celecoxib, Meloxicam, Ibuprofen, and Indomethacin. This selection was based on the ligand selectivity towards COX-1 or COX-2 and their binding mode. An interaction profile of each NSAID was compiled to detect the residues that are key for their binding mode, highlighting the interaction made by the Me group. Furthermore, we rigorously validated our models based on structural accuracy (RMSD < 1) and (R2 > 70) using eight NSAIDs and thirteen compounds with IC50 values for each enzyme. Therefore, this model can be used for the binding mode prediction of small and structurally rigid compounds that work as COX inhibitors or the prediction of new compounds that are designed by means of a structure-based approach. Full article
(This article belongs to the Special Issue Methyl-Containing Pharmaceuticals)
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23 pages, 1144 KiB  
Article
The Impact of Professionalism Theory Constructs on the Applicability of Forensic Accounting Services: Evidence from Jordan
Int. J. Financial Stud. 2023, 11(4), 141; https://doi.org/10.3390/ijfs11040141 (registering DOI) - 04 Dec 2023
Abstract
This study aims to provide an understanding of the impact of professionalism theory constructs on the applicability of forensic accounting services, as well as reviewing the obstacles to implementing the profession of forensic accounting through a literature review. The accounting side of the [...] Read more.
This study aims to provide an understanding of the impact of professionalism theory constructs on the applicability of forensic accounting services, as well as reviewing the obstacles to implementing the profession of forensic accounting through a literature review. The accounting side of the study explores the profession of forensic accounting and the sociological side of the study will focus on professionalism theory, more specifically Pavalko’s 1988 model. A quantitative method was used in this study; 154 questionnaires from Certified Public Accountants (CPAs) were validated and used in the data analysis. Data analysis was conducted using SmartPLS, which was used for testing the study’s hypotheses. The results demonstrated that the professionalism theory constructs have a significant impact on the applicability of forensic accounting services. There was an indication that six out of eight constructs had a positive impact, which are, code of ethics, commitment, intellectual technique, motivation, training, and relevance to social values, leaving only autonomy and sense of community with no impact shown. This study recommends that forensic accountants and practitioners contribute to developing the profession of forensic accounting and to provide services with high quality. The study’s significant constructs can inform the development of training programs for aspiring forensic accountants in Jordan, emphasizing ethics, commitment, technical expertise, motivation, training, and social values. These findings may also apply to other countries. Full article
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12 pages, 526 KiB  
Review
Situational Awareness in the Context of Clinical Practice
Healthcare 2023, 11(23), 3098; https://doi.org/10.3390/healthcare11233098 (registering DOI) - 04 Dec 2023
Abstract
In the context of clinical practice, situational awareness refers to conscious awareness (knowledge), which is a mental model of a given clinical situation in terms of its elements and the significance of their interrelation. Situational awareness (SA) facilitates clinical reasoning, diagnostic accuracy, and [...] Read more.
In the context of clinical practice, situational awareness refers to conscious awareness (knowledge), which is a mental model of a given clinical situation in terms of its elements and the significance of their interrelation. Situational awareness (SA) facilitates clinical reasoning, diagnostic accuracy, and appropriate goal-directed performance, and it enables clinicians to immediately adapt treatment strategies in response to changes in clinical situational actualities and to modify the course of goal-directed activities accordingly. It also helps clinicians prepare future operational plans and procedures based on the projection of situational developments. SA, therefore, is an important prerequisite for safe clinical procedures. The purpose of this narrative review is to highlight certain cognitive and external (environmental) situational factors that influence the development of situational awareness. Understanding the dynamic, adaptive, and complex interactions between these factors may assist clinicians and managers of healthcare systems in developing methods aimed at facilitating the acquisition of accurate clinical situational awareness and, in turn, may bring about a reduction in the incidence of SA, diagnostic, and operational errors. Full article
17 pages, 5602 KiB  
Article
New Formulation of a Subunit Vaccine Candidate against Lawsonia intracellularis Increases Humoral and Cellular Immune Responses
Vaccines 2023, 11(12), 1817; https://doi.org/10.3390/vaccines11121817 (registering DOI) - 04 Dec 2023
Abstract
Previously, we designed a subunit vaccine candidate based on three L. intracellularis antigens with promising results in pigs. In this study, antigens were produced individually to achieve an even antigen ratio in the formulation. The emulsion characterization included the drop size and the [...] Read more.
Previously, we designed a subunit vaccine candidate based on three L. intracellularis antigens with promising results in pigs. In this study, antigens were produced individually to achieve an even antigen ratio in the formulation. The emulsion characterization included the drop size and the mechanical and thermal stability. Immune response was evaluated by indirect and sandwich ELISAs, qPCR, and flow cytometry. The vaccine candidate’s safety was assessed by histopathology and monitoring the clinical behavior of animals. The average production yielded for the chimeric antigen as inclusion bodies was around 75 mg/L. The formulation showed mechanical and thermal stability, with a ratio Hu/Ho > 0.85 and a drop size under 0.15 nm. Antigens formulated at a ratio of 1:1:1 induced a significant immune response in inoculated pigs that persisted until the end of the experiment (week 14). The dose of 200 μg significantly activated cellular response measured by transcriptional and translational levels of cytokines. The cell proliferation assay revealed an increment of lymphocytes T CD4+ at the same dose. Animals gained weight constantly and showed proper clinical behavior during immunization assays. This research demonstrated the immunological robustness of the new subunit vaccine candidate against Porcine Proliferative Enteropathy evenly formulated with three chimeric antigens of L. intracellularis. Full article
(This article belongs to the Special Issue Porcine Vaccines: Enhancing Health, Productivity, and Welfare)
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13 pages, 1167 KiB  
Article
An Ionic Liquid Electrolyte Additive for High-Performance Lithium–Sulfur Batteries
Materials 2023, 16(23), 7504; https://doi.org/10.3390/ma16237504 (registering DOI) - 04 Dec 2023
Abstract
With the development of mobile electronic devices, there are more and more requirements for high-energy storage equipment. Traditional lithium-ion batteries, like lithium–iron phosphate batteries, are limited by their theoretical specific capacities and might not meet the requirements for high energy density in the [...] Read more.
With the development of mobile electronic devices, there are more and more requirements for high-energy storage equipment. Traditional lithium-ion batteries, like lithium–iron phosphate batteries, are limited by their theoretical specific capacities and might not meet the requirements for high energy density in the future. Lithium–sulfur batteries (LSBs) might be ideal next-generation energy storage devices because they have nearly 10 times the theoretical specific capacities of lithium-ion batteries. However, the severe capacity decay of LSBs limits their application, especially at high currents. In this study, an ionic liquid (IL) electrolyte additive, TDA+TFSI, was reported. When 5% of the TDA+TFSI additive was added to a traditional ether-based organic electrolyte, the cycling performance of the LSBs was significantly improved compared with that of the LSBs with the pure traditional organic electrolyte. At a rate of 0.5 C, the discharge specific capacity in the first cycle of the LSBs with the 5% TDA+TFSI electrolyte additive was 1167 mAh g−1; the residual specific capacities after 100 cycles and 300 cycles were 579 mAh g−1 and 523 mAh g−1, respectively; and the average capacity decay rate per cycle was only 0.18% in 300 cycles. Moreover, the electrolyte with the TDA+TFSI additive had more obvious advantages than the pure organic ether-based electrolyte at high charge and discharge currents of 1.0 C. The residual discharge specific capacities were 428 mAh g−1 after 100 cycles and 399 mAh g−1 after 250 cycles, which were 13% higher than those of the LSBs without the TDA+TFSI additive. At the same time, the Coulombic efficiencies of the LSBs using the TDA+TFSI electrolyte additive were more stable than those of the LSBs using the traditional organic ether-based electrolyte. The results showed that the LSBs with the TDA+TFSI electrolyte additive formed a denser and more uniform solid electrolyte interface (SEI) film during cycling, which improved the stability of the electrochemical reaction. Full article
10 pages, 255 KiB  
Article
Demographic Characteristics of Unvaccinated Asymptomatic and Symptomatic SARS-CoV-2 Cases in Barwon South West, Victoria, Australia
Pathogens 2023, 12(12), 1420; https://doi.org/10.3390/pathogens12121420 (registering DOI) - 04 Dec 2023
Abstract
We investigated 328 SARS-CoV-2 cases in Barwon South West, Victoria, Australia, in the 2020 pre-vaccination period, comparing infections with symptoms to those that remained asymptomatic. De-identified self-reported data on case characteristics and symptom progression from three sequential questionnaires were examined. Multivariable logistic regression [...] Read more.
We investigated 328 SARS-CoV-2 cases in Barwon South West, Victoria, Australia, in the 2020 pre-vaccination period, comparing infections with symptoms to those that remained asymptomatic. De-identified self-reported data on case characteristics and symptom progression from three sequential questionnaires were examined. Multivariable logistic regression was used to model associations between demographic profiles and symptoms. Asymptomatic infections were more than three times as likely to be seen in ethnic minority groups than the Caucasian population after adjusting for gender and age [OR 3.2, 95% CI 1.5–6.7, p < 0.01] and were more common among cases of Asian background [OR 2.8, 95%CI 1.2–6.4]. Asymptomatic infections were also more common in youth and younger adults, but cases were approximately seven times more likely to be in seniors (≥65 years) compared with those 24 years of age or younger after adjusting for sex and ethnicity [OR 6.9, 95% CI 1.3–35.8]. The overrepresentation of ethnic minority groups among asymptomatic infections is suggestive of genetic haplotype variability by ethnic group, conferring greater cross-protection from other coronaviruses in the initial phase of the COVID-19 pandemic. Replication of this analysis in the post-vaccination era and reassessment of symptom expression according to ethnicity in a community with established vaccine and infection-induced immunity would determine whether this is a sustained association or one confined to the early stages of a pandemic in an immunologically naive population. These findings may, in part, reflect differences in testing patterns by ethnicity and true differences in disease expression, both of which are important to understand in order to inform transmission prevention strategies and tailored risk messaging according to ethnic background. Full article
(This article belongs to the Special Issue Epidemiology and Outcomes Research in Infectious Diseases)
15 pages, 309 KiB  
Article
The Protein Composition of Bovine Milk from Once-a-Day and Twice-a-Day Milking Production Systems in New Zealand
Dairy 2023, 4(4), 689-703; https://doi.org/10.3390/dairy4040047 (registering DOI) - 04 Dec 2023
Abstract
An increasing number of dairy farmers in New Zealand (NZ) have adopted a once-a-day (OAD) milking production system, and little is known about the impact of this production system on milk protein composition. The objective of this study was to evaluate the effect [...] Read more.
An increasing number of dairy farmers in New Zealand (NZ) have adopted a once-a-day (OAD) milking production system, and little is known about the impact of this production system on milk protein composition. The objective of this study was to evaluate the effect of OAD milking on the protein composition in milk from individual cows. Milk was sampled in early, mid-, and late lactation from cows kept at Massey University farms Dairy No. 1 (OAD milking) and Dairy No. 4 (TAD milking) in Palmerston North, NZ. The yields of total milk and milk solids, the proximate composition, and the protein composition were determined. Results showed that OAD milking yielded less milk and milk solids than TAD milking. However, no significant differences in protein, fat, and lactose contents were found. While the proportions of total casein (CN), total whey proteins, αs1-CN, β-CN, and β-lactoglobulin were not affected by the milking frequency, milk from a OAD milking system contained higher proportions of αs2-CN and κ-CN and lower proportions of α-lactalbumin. These proteins also changed differently throughout the milking season in a OAD milking system than in a TAD milking system. These changes in the protein composition of the milk observed in a OAD milking system could have implications for its processing properties and product quality. Full article
(This article belongs to the Section Dairy Farm System and Management)
23 pages, 6958 KiB  
Article
Skin Imaging: A Digital Twin for Geometric Deviations on Manufactured Surfaces
Appl. Sci. 2023, 13(23), 12971; https://doi.org/10.3390/app132312971 (registering DOI) - 04 Dec 2023
Abstract
Closed-loop manufacturing is crucial in Industry 4.0, since it provides an online detection–correction cycle to optimize the production line by using the live data provided from the product being manufactured. By integrating the inspection system and manufacturing processes, the production line achieves a [...] Read more.
Closed-loop manufacturing is crucial in Industry 4.0, since it provides an online detection–correction cycle to optimize the production line by using the live data provided from the product being manufactured. By integrating the inspection system and manufacturing processes, the production line achieves a new level of accuracy and savings on costs. This is far more crucial than only inspecting the finished product as an accepted or rejected part. Modeling the actual surface of the workpiece in production, including the manufacturing errors, enables the potential to process the provided live data and give feedback to production planning. Recently introduced “skin imaging methodology can generate 2D images as a comprehensive digital twin for geometric deviations on any scanned 3D surface including analytical geometries and sculptured surfaces. Skin-Image has been addressed as a novel methodology for continuous representation of unorganized discrete 3D points, by which the geometric deviation on the surface is shown using image intensity. Skin-Image can be readily used in online surface inspection for automatic and precise 3D defect segmentation and characterization. It also facilitates search-guided sampling strategies. This paper presents the implementation of skin imaging for primary engineering surfaces. The results, supported by several industrial case studies, show high efficiency of skin imaging in providing models of the real manufactured surfaces. Full article
(This article belongs to the Special Issue Smart Manufacturing and Industry 4.0, 2nd Edition)
30 pages, 6063 KiB  
Article
Geographic and Ecological Diversity of Green Sulfur Bacteria in Hot Spring Mat Communities
Microorganisms 2023, 11(12), 2921; https://doi.org/10.3390/microorganisms11122921 (registering DOI) - 04 Dec 2023
Abstract
Three strains of thermophilic green sulfur bacteria (GSB) are known; all are from microbial mats in hot springs in Rotorua, New Zealand (NZ) and belong to the species Chlorobaculum tepidum. Here, we describe diverse populations of GSB inhabiting Travel Lodge Spring (TLS) [...] Read more.
Three strains of thermophilic green sulfur bacteria (GSB) are known; all are from microbial mats in hot springs in Rotorua, New Zealand (NZ) and belong to the species Chlorobaculum tepidum. Here, we describe diverse populations of GSB inhabiting Travel Lodge Spring (TLS) (NZ) and hot springs ranging from 36.1 °C to 51.1 °C in the Republic of the Philippines (PHL) and Yellowstone National Park (YNP), Wyoming, USA. Using targeted amplification and restriction fragment length polymorphism analysis, GSB 16S rRNA sequences were detected in mats in TLS, one PHL site, and three regions of YNP. GSB enrichments from YNP and PHL mats contained small, green, nonmotile rods possessing chlorosomes, chlorobactene, and bacteriochlorophyll c. Partial 16S rRNA gene sequences from YNP, NZ, and PHL mats and enrichments from YNP and PHL samples formed distinct phylogenetic clades, suggesting geographic isolation, and were associated with samples differing in temperature and pH, suggesting adaptations to these parameters. Sequences from enrichments and corresponding mats formed clades that were sometimes distinct, increasing the diversity detected. Sequence differences, monophyly, distribution patterns, and evolutionary simulation modeling support our discovery of at least four new putative moderately thermophilic Chlorobaculum species that grew rapidly at 40 °C to 44 °C. Full article
(This article belongs to the Special Issue Phototrophic Bacteria 2.0)
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33 pages, 950 KiB  
Review
Role of Mitochondria in Inflammatory Bowel Diseases: A Systematic Review
Int. J. Mol. Sci. 2023, 24(23), 17124; https://doi.org/10.3390/ijms242317124 (registering DOI) - 04 Dec 2023
Abstract
Mitochondria are key cellular organelles whose main function is maintaining cell bioenergetics by producing ATP through oxidative phosphorylation. However, mitochondria are involved in a much higher number of cellular processes. Mitochondria are the home of key metabolic pathways like the tricarboxylic acid cycle [...] Read more.
Mitochondria are key cellular organelles whose main function is maintaining cell bioenergetics by producing ATP through oxidative phosphorylation. However, mitochondria are involved in a much higher number of cellular processes. Mitochondria are the home of key metabolic pathways like the tricarboxylic acid cycle and β-oxidation of fatty acids, as well as biosynthetic pathways of key products like nucleotides and amino acids, the control of the redox balance of the cell and detoxifying the cell from H2S and NH3. This plethora of critical functions within the cell is the reason mitochondrial function is involved in several complex disorders (apart from pure mitochondrial disorders), among them inflammatory bowel diseases (IBD). IBD are a group of chronic, inflammatory disorders of the gut, mainly composed of ulcerative colitis and Crohn’s disease. In this review, we present the current knowledge regarding the impact of mitochondrial dysfunction in the context of IBD. The role of mitochondria in both intestinal mucosa and immune cell populations are discussed, as well as the role of mitochondrial function in mechanisms like mucosal repair, the microbiota– and brain–gut axes and the development of colitis-associated colorectal cancer. Full article
13 pages, 780 KiB  
Review
Navigating a Complex Intersection: Immunotherapy and Radiotherapy Synergy in Squamous Cell Carcinoma of the Skin—A Comprehensive Literature Review
Cosmetics 2023, 10(6), 165; https://doi.org/10.3390/cosmetics10060165 (registering DOI) - 04 Dec 2023
Abstract
Skin squamous cell carcinoma (SCC) represents a major public health concern due to its high incidence and potential for local invasion and metastasis. Compared to local recurrence, metastatic SCC represents an even greater therapeutic challenge. Once distant metastasis occurs, the disease becomes incurable, [...] Read more.
Skin squamous cell carcinoma (SCC) represents a major public health concern due to its high incidence and potential for local invasion and metastasis. Compared to local recurrence, metastatic SCC represents an even greater therapeutic challenge. Once distant metastasis occurs, the disease becomes incurable, and treatment focuses on palliation and prolonging survival. The immune microenvironment of SCC is characterized by an infiltration of immune cells, including tumor-infiltrating lymphocytes. In addition to its direct cytotoxic effects, radiotherapy also induces immunomodulatory effects within the tumor microenvironment. Radiation can promote the release of tumor-associated antigens and induce immunogenic cell death, thereby enhancing the recognition of tumor cells by the immune system. Immunotherapy and radiotherapy have emerged as promising therapeutic modalities for metastatic SCC. This literature review aims to evaluate the potential synergy between these treatments and shed light on their combined efficacy. Within the manuscript, we present a compelling case report of a patient with advanced SCC who exhibited resistance to the combined regimen of immunotherapy and radiotherapy, leading to disease progression. Despite the increasing evidence supporting the synergy between these modalities, this case underscores the complex nature of treatment response and the importance of considering individual patient characteristics. Full article
15 pages, 4571 KiB  
Article
Identification of Pollution Sources in Urban Wind Environments Using the Regularized Residual Method
Atmosphere 2023, 14(12), 1786; https://doi.org/10.3390/atmos14121786 (registering DOI) - 04 Dec 2023
Abstract
The scale of cities is increasing with continuous urban development. Effective methods, such as the source term estimation (STE) method, must be established for identifying the sources of air pollution in cities to prevent economic losses and casualties caused by pollutant leakage. Herein, [...] Read more.
The scale of cities is increasing with continuous urban development. Effective methods, such as the source term estimation (STE) method, must be established for identifying the sources of air pollution in cities to prevent economic losses and casualties caused by pollutant leakage. Herein, methods for optimizing sensor configuration and identifying pollution sources are discussed, and an STE method based on the regularized minimum residual method is proposed. Urban wind environments were simulated using a computational fluid dynamics (CFD) model, and the results were compared with experimental data pertaining to the wind tunnel of an architectural ensemble to verify the model’s accuracy. The sensor layout was optimized using the simulated annealing (SA) algorithm and adjoint entropy, and the relationship between sensor responses and potential pollution sources was established using the CFD model. Pollutant concentrations measured using sensors were combined with the regularization method to extrapolate the pollution source strength, and the regularized minimum residual method was used to obtain the locations of the real pollution sources. The results show that compared with the Bayesian methods, the proposed method can more accurately identify pollution sources (100%), with a smaller source strength error of 2.01% for constant sources and one of 2.62% for attenuation sources. Full article
(This article belongs to the Special Issue Exposure to Indoor CO2 and Human Response)
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44 pages, 697 KiB  
Review
miRNAs and Substances Abuse: Clinical and Forensic Pathological Implications: A Systematic Review
Int. J. Mol. Sci. 2023, 24(23), 17122; https://doi.org/10.3390/ijms242317122 (registering DOI) - 04 Dec 2023
Abstract
Substance addiction is a chronic and relapsing brain disorder characterized by compulsive seeking and continued substance use, despite adverse consequences. The high prevalence and social burden of addiction are indisputable; however, the available intervention is insufficient. The modulation of gene expression and aberrant [...] Read more.
Substance addiction is a chronic and relapsing brain disorder characterized by compulsive seeking and continued substance use, despite adverse consequences. The high prevalence and social burden of addiction are indisputable; however, the available intervention is insufficient. The modulation of gene expression and aberrant adaptation of neural networks are attributed to the changes in brain functions under repeated exposure to addictive substances. Considerable studies have demonstrated that miRNAs are strong modulators of post-transcriptional gene expression in substance addiction. The emerging role of microRNA (miRNA) provides new insights into many biological and pathological processes in the central nervous system: their variable expression in different regions of the brain and tissues may play a key role in regulating the pathophysiological events of addiction. This work provides an overview of the current literature on miRNAs involved in addiction, evaluating their impaired expression and regulatory role in neuroadaptation and synaptic plasticity. Clinical implications of such modulatory capacities will be estimated. Specifically, it will evaluate the potential diagnostic role of miRNAs in the various stages of drug and substance addiction. Future perspectives about miRNAs as potential novel therapeutic targets for substance addiction and abuse will also be provided. Full article
(This article belongs to the Section Molecular Neurobiology)
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16 pages, 889 KiB  
Review
A Bioinformatics Toolkit for Next-Generation Sequencing in Clinical Oncology
Curr. Issues Mol. Biol. 2023, 45(12), 9737-9752; https://doi.org/10.3390/cimb45120608 (registering DOI) - 04 Dec 2023
Abstract
Next-generation sequencing (NGS) has taken on major importance in clinical oncology practice. With the advent of targeted therapies capable of effectively targeting specific genomic alterations in cancer patients, the development of bioinformatics processes has become crucial. Thus, bioinformatics pipelines play an essential role [...] Read more.
Next-generation sequencing (NGS) has taken on major importance in clinical oncology practice. With the advent of targeted therapies capable of effectively targeting specific genomic alterations in cancer patients, the development of bioinformatics processes has become crucial. Thus, bioinformatics pipelines play an essential role not only in the detection and in identification of molecular alterations obtained from NGS data but also in the analysis and interpretation of variants, making it possible to transform raw sequencing data into meaningful and clinically useful information. In this review, we aim to examine the multiple steps of a bioinformatics pipeline as used in current clinical practice, and we also provide an updated list of the necessary bioinformatics tools. This resource is intended to assist researchers and clinicians in their genetic data analyses, improving the precision and efficiency of these processes in clinical research and patient care. Full article
(This article belongs to the Special Issue Next-Generation Sequencing (NGS) Technique and Personalized Medicine)
13 pages, 3371 KiB  
Article
Measurement of Three-Dimensional Back Shapes of Normal Adults Using a Novel Three-Dimensional Imaging Mobile Surface Topography System (MSTS): An Intra- and Inter-Rater Reliability Study
Healthcare 2023, 11(23), 3099; https://doi.org/10.3390/healthcare11233099 (registering DOI) - 04 Dec 2023
Abstract
Postural and spinal deformities are major contributing factors to musculoskeletal (MSK) disorders. Posture screening and assessment can help to identify early morphological deformities, thereby preventing progression and reducing or correcting them with effective treatments. The study evaluates both intra- and inter-repeatability of using [...] Read more.
Postural and spinal deformities are major contributing factors to musculoskeletal (MSK) disorders. Posture screening and assessment can help to identify early morphological deformities, thereby preventing progression and reducing or correcting them with effective treatments. The study evaluates both intra- and inter-repeatability of using a mobile structured light sensor with a structured light pattern for building an accurate 3D human model and its use in postural screening. 16 young males (age: 25 ± 5.6 years, height: 172 ± 5.3 cm, mass: 69 ± 8.6 kg) participated without any musculoskeletal pain or pre-existing leg or spinal abnormalities. An iPad-based 3D mobile scanning tool, Structure SensorTM (2018 version), was used to capture the participants’ back and whole-body shape. The collected data (3D model) were realigned and processed in the open-source software, Netfabb BasicTM (7.2 version). For each participant, five trained raters individually measured three trials of standing back and body posture on two separate occasions to calculate both intra- and inter-rater reliability. With the use of this software, nine postural variables and angular displacements were individually measured by the raters. The results indicated good to excellent intra-rater and good to moderate inter-rater reliability for measuring 78% (7 out of 9) of postural variables with an ICC ranging from 0.70 to 0.98. The remaining 22% of variables (2 out of 9; lateral pelvic tilt and right frontal knee angle) showed moderate to low inter- and intra-rater reliability, with ICCs ranging from 0.26 to 0.79. Full article
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13 pages, 442 KiB  
Article
Assessment of Oral Health Knowledge, Attitudes, and Behaviours among University Students in the Asir Region—Saudi Arabia: A Cross-Sectional Study
Healthcare 2023, 11(23), 3100; https://doi.org/10.3390/healthcare11233100 (registering DOI) - 04 Dec 2023
Abstract
This cross-sectional study with a 3-month duration in 2023 was conducted amongst King Khalid University (KKU) students. This study used a self-administered, anonymous web-based survey with a simple random sampling strategy as part of its cross-sectional design. The questionnaire had four sections totalling [...] Read more.
This cross-sectional study with a 3-month duration in 2023 was conducted amongst King Khalid University (KKU) students. This study used a self-administered, anonymous web-based survey with a simple random sampling strategy as part of its cross-sectional design. The questionnaire had four sections totalling 26 questions to evaluate KAB. A chi-square test was used to evaluate significant differences between categories. Results: Of the 845 respondents who completed the survey, 43.78% were health-related students, while 56.21% were non-health-related students. The completed responses included bacteria causing gingival problems (60.81% vs. 36%), fizzy soft drinks adversely affecting teeth (67.83% vs. 40%), tobacco chewing or smoking possibly causing oral cancer (68.37% vs. 44%), white patches or dental plaque on teeth (61.89% vs. 41.47%), brushing teeth twice a day to improve oral health (81.62% vs. 42.52%), keeping teeth clean (64.86% vs. 41.68%), improper brushing leading to gum disease (70% vs. 40.63%), brushing with fluoridated toothpaste to prevent tooth decay (63% vs. 40%), bleeding gums denoting gum infection (26.98% vs. 21.30%), the importance of teeth similar to any body part (61.62% vs. 37.89%), prioritising teeth as other parts of the body (61.05% vs. 36.21%), brushing teeth twice daily (55.67% vs. 37.05%), and routine dental check-ups (55.40% vs. 14.10%) for health and non-health-related students, respectively (p < 0.05). Conclusion: The results of the current study demonstrated less oral health KAB in non-health-related students than in health-related students. Nonetheless, healthcare students provided erroneous information regarding oral health. Therefore, we urge the appropriate authorities to offer health and non-health-related students the best oral health promotion programmes and services, thereby seeking to improve their oral health knowledge while stressing the importance of practising excellent oral hygiene. Full article
11 pages, 1598 KiB  
Article
Effect of Hf Dopant on Resistance to CO Toxicity on ZrCo(110) Surface for H Adsorption
Metals 2023, 13(12), 1973; https://doi.org/10.3390/met13121973 (registering DOI) - 04 Dec 2023
Abstract
Co-adsorption of multi-components in ZrCo-based hydrogen storage materials can lead to a number of synergistic effects, such as the modification of adsorption sites, and further worsen the hydrogen storage capability. In this work, we explore the co-adsorption of H and CO on the [...] Read more.
Co-adsorption of multi-components in ZrCo-based hydrogen storage materials can lead to a number of synergistic effects, such as the modification of adsorption sites, and further worsen the hydrogen storage capability. In this work, we explore the co-adsorption of H and CO on the ZrCo(110) surface and find that the molecular CO can be adsorbed on the clean alloy surface and thus decrease the hydrogen storage ability of the alloy. Moreover, CO occupies the adsorption site of H and therefore prevents the adsorption and diffusion into the interior of the lattice. Fortunately, the Hf dopant reduces the number of adsorption sites of the CO molecule and inhibits the formation of carbides to a certain extent. In addition, the partial density of states (PDOS) result shows that there is almost no interaction between the s orbital of H and the s orbital of Co on the pure surface of pre-adsorbed CO, while on the Hf-doped surface of pre-adsorbed CO, the s orbital of H overlapped greatly with the s orbital of Co, indicating that Hf doping inhibits CO toxicity in the interaction between H and the surface. Hence, the doping of Hf has the effect of giving resistance to CO toxicity and is conducive to the adsorption of H. Full article
12 pages, 2591 KiB  
Article
Mass Balance Studies of Chlorpheniramine Hydrochloride in the Body of Channel Catfish (Ictalurus punctatus)
Animals 2023, 13(23), 3745; https://doi.org/10.3390/ani13233745 (registering DOI) - 04 Dec 2023
Abstract
This study aims to determine the mass balance of chlorpheniramine hydrochloride (ROBH) in the body of Channel catfish (Ictalurus punctatus). ROBH was administered orally at a dose of 20 mg/kg; following drug administration, the water samples were collected at predetermined time [...] Read more.
This study aims to determine the mass balance of chlorpheniramine hydrochloride (ROBH) in the body of Channel catfish (Ictalurus punctatus). ROBH was administered orally at a dose of 20 mg/kg; following drug administration, the water samples were collected at predetermined time points (12, 24, 48, 72, 96, 120, 144, and 168 h), the experimental fish were executed after the water samples were obtained at 168 h, and the tissue samples were collected separately from the bones. The water and tissue samples were analyzed by high-performance liquid chromatography coupled with tandem mass spectrometry (HPLC–MS/MS) for concentrations of ROBH and its potential major metabolites, 4-chlorohippuric acid (PCHA) and 4-chlorobenzoic acid (PCBA). The tissue samples were prepared using a modified QuEChERS procedure; the water samples were prepared using a liquid–liquid extraction (LLE) procedure. The results show that the recovery rate of ROBH in fish is very low, less than 2% of the total amount of the drug, and the recovery in water can reach 80.7% of the total amount of the drug. The content of PCBA accounted for 42.4% of the total amount of the drug; the content of ROBH accounted for 38.3% of the total amount of the drug. The content of PCHA accounted for less than 1% of the total amount of the drug. The results show that, after a single administration, ROBH is rapidly metabolized in vivo and excreted in the form of ROBH as well as metabolite PCBA. ROBH and PCBA can be used as the main targets for the metabolism detection of ROBH in Channel catfish. Full article
(This article belongs to the Special Issue Pharmacokinetics and Pharmacodynamics in Aquatic Animals)
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12 pages, 2433 KiB  
Article
A New Approach to Predicting Vertical Permeability for Carbonate Rocks in the Southern Mesopotamian Basin
Minerals 2023, 13(12), 1519; https://doi.org/10.3390/min13121519 (registering DOI) - 04 Dec 2023
Abstract
Reservoir performance depends on many factors, and the most important one is permeability anisotropy. In addition, with high heterogeneity, it is essential to find unique relationships to predict permeability. Therefore, this study aims to predict vertical permeability based on horizontal permeability and porosity [...] Read more.
Reservoir performance depends on many factors, and the most important one is permeability anisotropy. In addition, with high heterogeneity, it is essential to find unique relationships to predict permeability. Therefore, this study aims to predict vertical permeability based on horizontal permeability and porosity and to find new equations for carbonate reservoirs. This work relied on the 398 measured points of cores data collected from several wells in carbonate reservoirs. A new correlation for predicting vertical permeability for the whole data (369 samples) as a function of horizontal permeability and porosity has been developed. The results indicate that this new correlation can estimate the vertical permeability with correlation coefficients (RSQ) of 0.853. Then, the used data were divided into four groups depending on the Kv/Kh values: less than 0.1, 1–0.1, 1–10, and more than 10, and a new correlation for permeability prediction for each group has been developed with good RSQ values of 0.751, 0.947, 0.963, and 0.826, respectively. The previous studies lack the correlations to predict vertical permeability in carbonate reservoirs, so this study can be considered as a reference for similar cases. Full article
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22 pages, 1827 KiB  
Article
The Relationship between High-Tech Industrial Agglomeration and Regional Innovation: A Meta-Analysis Investigation in China
Sustainability 2023, 15(23), 16545; https://doi.org/10.3390/su152316545 (registering DOI) - 04 Dec 2023
Abstract
High-tech industrial agglomeration enhances the technological level and value of regional industries. It is considered to be a new and effective way to drive China’s regional innovation and development at present. Numerous studies indicate that high-tech industrial agglomeration contributes positively to regional innovation, [...] Read more.
High-tech industrial agglomeration enhances the technological level and value of regional industries. It is considered to be a new and effective way to drive China’s regional innovation and development at present. Numerous studies indicate that high-tech industrial agglomeration contributes positively to regional innovation, but the current academic discussion on this issue has not yet reached a unified opinion. In various research contexts, it has also been pointed out that there may be a negative correlation or non-linear relationship between the two. This contradictory relationship makes it difficult to generalize the current research findings to realistic application scenarios. Therefore, to clarify the relationship between the two scientifically, this study employs meta-analysis, reanalyzing 833 effect values derived from 69 independent research samples based on Chinese data. The findings reveal a moderately positive correlation (r = 0.204) between the agglomeration of high-tech industries and regional innovation in China. In particular, high-tech industrial agglomeration significantly contributes to regional innovation under the paths of diversified agglomeration and competitive agglomeration. We further found that sampling region, measurement approach, measurement perspective, research methodology, and year of publication all exhibit significant moderating effects on the relationship between the two variables. Based on meta-analysis, this study not only scientifically responds to the controversy of the relationship between high-tech industrial agglomeration and regional innovation but also further reveals the inner conduction mechanism between the two. It is of great significance in exploring future studies in related fields. Full article
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16 pages, 20806 KiB  
Article
Study on Dynamic Crack Expansion and Size Effect of Back–Filling Concrete under Uniaxial Compression
Materials 2023, 16(23), 7503; https://doi.org/10.3390/ma16237503 (registering DOI) - 04 Dec 2023
Abstract
With the continuous expansion of the application range of gob–side entry retaining technology, the depth, height, and advancing speed of coal seams also increase, which brings great problems to the stability control of surrounding rock structures of gob–side entry retaining. As one of [...] Read more.
With the continuous expansion of the application range of gob–side entry retaining technology, the depth, height, and advancing speed of coal seams also increase, which brings great problems to the stability control of surrounding rock structures of gob–side entry retaining. As one of the main bearing structures of the surrounding rock, the stability of the roadway–side support body is a key factor for the success of gob–side entry retaining. In order to study the deformation characteristics and instability mechanism of roadway-side support body, based on the roadway–side support materials of gob-side entry retaining, the dynamic expansion test of back–filling concrete cracks under uniaxial compression was carried out. The YOLOv5 algorithm was applied to establish the fine identification and quantitative characterization method of macroscopic cracks of the samples, and the dynamic expansion rule of roadway-side support body cracks and its dimensional effect were revealed by combining the fractal theory. The results show that the F1 value and average precision mean of the intelligent dynamic crack identification model reached 75% and 71%, respectively, the GIoU loss value tends to fit around 0.038, and the model reached the overall optimal solution. During the uniaxial compression process, micro cracks on the surface of the back–filling concrete first initiated at the end, and after reaching the yield stress, the macroscopic cracks developed significantly. Moreover, several secondary cracks expanded, pooled, and connected from the middle of the specimen to the two ends, inducing the overall instability of the specimen. The surface crack expansion rate, density, and fractal dimension all show stage change characteristics with the increase in stress, and the main crack expansion rate has obvious precursor characteristics. With the increase in the size, the decrease in crack density after back–filling concrete failures gradually decreases from 93.19% to 4.08%, the surface crack network develops from complex to simple, and the failure mode transits from tensile failure to shear failure. The above research results provide a basic experimental basis for design optimization and instability prediction of a roadway–side support body for engineering-scale applications. Full article
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27 pages, 1600 KiB  
Article
Hydraulic Analysis of a Passive Wedge Wire Water Intake Screen for Ichthyofauna Protection
Appl. Sci. 2023, 13(23), 12970; https://doi.org/10.3390/app132312970 (registering DOI) - 04 Dec 2023
Abstract
A passive wedge screen, thanks to its many functional and environmental advantages, has recently become a popular type of surface water intake for municipal and industrial purposes. The design solutions proposed in this paper for a passive wedge wire screen intake model and [...] Read more.
A passive wedge screen, thanks to its many functional and environmental advantages, has recently become a popular type of surface water intake for municipal and industrial purposes. The design solutions proposed in this paper for a passive wedge wire screen intake model and two different deflectors have been experimentally tested under conditions that can be considered as no-flow conditions at the hydraulic flume. There was only a slight flow associated with the operation of the screen, while there was almost no flow in the hydraulic channel itself, such that it would be considered a watercourse. A hydraulic analysis was carried out, including velocity distribution around the screen as well as the determination of head losses with or without deflectors installed inside the screen. Lower inlet and inflow velocities to the surface of the water intake reduce the risk of injury or death to small fish and fry as well as attracting pollutants understood as sediments, debris, and plant remains floating in the river. In order to achieve the lowest possible maximum inlet and inflow velocities at the highest possible intake capacity, it was necessary to equalize the approach velocity distributions. It was shown that by using the proposed deflectors, the approach velocity distributions were equalized and the maximum values of inflow and inlet velocities were reduced. A water intake screen with a deflector with an uneven porosity distribution equalized the approach velocities better than a deflector with equal openings, but the differences were small. Installing the wedge screen model reduced the maximum inlet velocity from exceeding 2 m/s to a value of 0.08 m/s, and after installing deflectors with equal and unequal openings to values of 0.06 m/s and 0.05 m/s, respectively. In addition to laboratory tests, the paper describes the numerical simulations performed in ANSYS Fluent software. The results of the simulations made it possible to obtain a broader study, as well as to compare the velocity values obtained at the measuring points during the laboratory tests. Full article
25 pages, 4925 KiB  
Article
Understanding the Influence of Genre-Specific Music Using Network Analysis and Machine Learning Algorithms
Big Data Cogn. Comput. 2023, 7(4), 180; https://doi.org/10.3390/bdcc7040180 (registering DOI) - 04 Dec 2023
Abstract
This study analyzes a network of musical influence using machine learning and network analysis techniques. A directed network model is used to represent the influence relations between artists as nodes and edges. Network properties and centrality measures are analyzed to identify influential patterns. [...] Read more.
This study analyzes a network of musical influence using machine learning and network analysis techniques. A directed network model is used to represent the influence relations between artists as nodes and edges. Network properties and centrality measures are analyzed to identify influential patterns. In addition, influence within and outside the genre is quantified using in-genre and out-genre weights. Regression analysis is performed to determine the impact of musical attributes on influence. We find that speechiness, acousticness, and valence are the top features of the most influential artists. We also introduce the IRDI, an algorithm that provides an innovative approach to quantify an artist’s influence by capturing the degree of dominance among their followers. This approach underscores influential artists who drive the evolution of music, setting trends and significantly inspiring a new generation of artists. The independent cascade model is further employed to open up the temporal dynamics of influence propagation across the entire musical network, highlighting how initial seeds of influence can contagiously spread through the network. This multidisciplinary approach provides a nuanced understanding of musical influence that refines existing methods and sheds light on influential trends and dynamics. Full article
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25 pages, 5016 KiB  
Article
Integrated Multi-Model Approach for Assessing Groundwater Vulnerability in Rajasthan’s Semi-Arid Zone: Incorporating DRASTIC and SINTACS Variants
Hydrology 2023, 10(12), 231; https://doi.org/10.3390/hydrology10120231 (registering DOI) - 04 Dec 2023
Abstract
Groundwater pollution in Rajasthan, India, poses significant challenges due to the region’s heavy reliance on this resource for drinking and irrigation. Given the increasing water scarcity and overexploitation, this study assesses the susceptibility of groundwater pollution in this semi-arid area. We applied and [...] Read more.
Groundwater pollution in Rajasthan, India, poses significant challenges due to the region’s heavy reliance on this resource for drinking and irrigation. Given the increasing water scarcity and overexploitation, this study assesses the susceptibility of groundwater pollution in this semi-arid area. We applied and compared vulnerability mapping methods, DRASTIC and SINTACS, and their modified versions. These methodologies considered various geological and environmental factors such as depth-to-water table, recharge, aquifer conductivity, soil, and topography. The modified versions also integrated land use and temperature data for enhanced sensitivity. Validation was achieved by comparing contaminant data from the Central Ground Water Board (CGWB), India, focusing on primary contaminants such as fluoride, nitrate, chloride, and total dissolved solids (TDS). The results strongly align with the modified methodologies and observed groundwater ion values. Specifically, more than half of the 300 sample points analyzed indicated TDS values exceeding the permissible 300 ppm limit, with over 80 points surpassing 500 ppm. The vulnerability was classified into the following five categories: very low; low; medium; high; and very high. Notably, 30.53% of the area displayed “very high” vulnerability under the modified DRASTIC model. Districts like Jalore, Pali, Sirohi, and Jodhpur emerged as highly vulnerable zones, while areas within Udaipur, Kota, and Jaipur, among others, showed very high vulnerability. This research highlights the importance of conducting groundwater vulnerability assessments, especially for regions grappling with water scarcity like Rajasthan. The findings from this research are pivotal in guiding sustainable ground water resource management, as well as advocating continual monitoring and effective groundwater conservation strategies in the region. Full article
(This article belongs to the Special Issue Recent Advances in Water and Water Resources Engineering)

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