bluuebunny/crossref_metadata_2025 huggingface dataset:
Economic and Energetic Assessment and Comparison of Solar Heating and Cooling Systems
Authors: Delač Boris , Pavković Branimir , Glažar Vladimir
Published: January 2023

Solar heating and cooling (SHC) systems are currently attracting attention, especially in times of increasing energy prices and supply crises. In times of lower energy prices, absorption SHC systems were not competitive to compression cooling supported by photovoltaic (PV) modules due to the high investment costs and total energy efficiency. This paper aims to discuss the current changes in energy supply and energy prices in terms of the feasibility of the application of a small absorption SHC system in a mild Mediterranean climate. The existing hospital complex restaurant SHC system with evacuated tube solar collectors and a small single-stage absorption chiller was used as a reference system for extended analysis. Dynamic simulation models based on solar thermal collectors, PV modules, absorption chillers and air-to-water heat pumps were developed for reliable research and system comparison. The results showed that primary energy consumption in SHC systems designed to cover base energy load strongly depends on the additional energy source, e.g., boiler or heat pump. Absorption SHC systems can be price competitive to air-to-water heat pump (AWHP) systems with PV collectors only in the case of reduced investment costs and increased electricity price. To reach acceptable economic viability of the absorption SHC system, investment price should be at least equal to or lower than a comparable AWHP system.
A Comparative Analysis of Hyperparameter Tuned Stochastic Short Term Load Forecasting for Power System Operator
Authors: Vardhan B. V. Surya , Khedkar Mohan , Srivastava Ishan , Thakre Prajwal , Bokde Neeraj Dhanraj
Published: January 2023

Intermittency in the grid creates operational issues for power system operators (PSO). One such intermittent parameter is load. Accurate prediction of the load is the key to proper planning of the power system. This paper uses regression analyses for short-term load forecasting (STLF). Assumed load data are first analyzed and outliers are identified and treated. The cleaned data are fed to regression methods involving Linear Regression, Decision Trees (DT), Support Vector Machine (SVM), Ensemble, Gaussian Process Regression (GPR), and Neural Networks. The best method is identified based on statistical analyses using parameters such as Root Mean Square Error (RMSE), Mean Absolute Error (MAE), Mean Square Error (MSE), R2, and Prediction Speed. The best method is further optimized with the objective of reducing MSE by tuning hyperparameters using Bayesian Optimization, Grid Search, and Random Search. The algorithms are implemented in Python and Matlab Platforms. It is observed that the best methods obtained for regression analysis and hyperparameter tuning for an assumed data set are Decision Trees and Grid Search, respectively. It is also observed that, due to hyperparameter tuning, the MSE is reduced by 12.98%.
Model Predictive Control of DC–DC Boost Converter Based on Generalized Proportional Integral Observer
Authors: Niu Rongchao , Zhang Hongyu , Song Jian
Published: January 2023

Due to the nonminimum phase characteristics and nonlinearity of boost converters, the control design is always a challenging issue. A novel model predictive control strategy is proposed for the boost converter in this work. First, the Super-Twisting algorithm is applied to current control, and the input–output plant for voltage control is derived based on the linearization technique. All the model uncertainties are defined as lumped disturbances, and a generalized proportional integral observer is designed to estimate the lumped disturbance. Second, a composite predictive approach is developed on the basis of the predictive model and disturbance estimations. By solving the cost function directly, the optimal control law is derived explicitly. Lastly, the effectiveness of the proposed control strategy is verified by both simulation and experimental results.
Perspectives on Electric Motor Market Transformation for a Net Zero Carbon Economy
Authors: de Almeida Anibal T. , Ferreira Fernando J. T. E. , Fong João
Published: January 2023

Energy efficiency is one of the most powerful strategies to mitigate the impacts of climate change by reducing energy demand, which in turn reduces the emissions of Green House Gases (GHG), as well as reducing the burden on the supply side renewable generation expansion. Because electric motors systems represent such a large share of the overall electricity consumption (over 50%), large savings potential could be made available by the use of energy-efficient motor systems both in new installations and by accelerating the replacement of old inefficient motors. Since electric motors are very reliable, their lifetime is long (according to recent studies it may exceed 20 years) which translates into a very inefficient existing stock despite worldwide policy efforts. This paper analyzes the current efficiency of the installed stock and the causes for its low efficiency, possible policy options to increase its the efficiency, the role of new technologies and improvements possible by targeting the entire motor system at the time of motor replacement. The paper presents an innovative analysis of the estimated impact of increasing the uptake of high-efficiency motors and motor systems; effective policies could translate into 100 TWh/year in the European Union if additional measures, such as addressing oversizing, proper controls (VSDs) and digitisation, are also implemented. If similar measures were adopted globally, the savings triggered could be at least tenfold reaching over 1000 TWh/year.
Research on 3D Phenotypic Reconstruction and Micro-Defect Detection of Green Plum Based on Multi-View Images
Authors: Zhang Xiao , Huo Lintao , Liu Ying , Zhuang Zilong , Yang Yutu , Gou Binli
Published: January 2023

Rain spots on green plum are superficial micro-defects. Defect detection based on a two-dimensional image is easily influenced by factors such as placement position and light and is prone to misjudgment and omission, which are the main problems affecting the accuracy of defect screening of green plum. In this paper, using computer vision technology, an improved structure from motion (SFM) and patch-based multi-view stereo (PMVS) algorithm based on similar graph clustering and graph matching is proposed to perform three-dimensional sparse and dense reconstruction of green plums. The results show that, compared with the traditional algorithm, the running time of this algorithm is lower, at only 26.55 s, and the mean values of camera optical center error and pose error are 0.019 and 0.631, respectively. This method obtains a higher reconstruction accuracy to meet the subsequent plum micro-defect detection requirements. Aiming at the dense point cloud model of green plums, through point cloud preprocessing, the improved adaptive segmentation algorithm based on the Lab color space realizes the effective segmentation of the point cloud of green plum micro-defects. The experimental results show that the average running time of the improved adaptive segmentation algorithm is 2.56 s, showing a faster segmentation speed and better effect than the traditional K-means and K-means++ algorithms. After clustering the micro-defect point cloud, the micro-defect information of green plums was extracted on the basis of random sample consensus (RANSAC) plane fitting, which provides a theoretical model for further improving the accuracy of sorting the appearance quality of green plums.
Bacillus subtilis K-C3 as Potential Starter to Improve Nutritional Components and Quality of Shrimp Paste and Corresponding Changes during Storage at Two Alternative Temperatures
Authors: Pongsetkul Jaksuma , Benjakul Soottawat , Boonchuen Pakpoom
Published: January 2023

This study aimed to evaluate Bacillus subtilis K-C3 as a potential starter to improve shrimp paste quality, particularly in terms of nutritional profiles. The quality/characteristic changes of shrimp paste with and without inoculation during storage for 18 months when stored at low (4 °C) and room (28 °C) temperature were also investigated. The results found that this B. strain increased essential amino acids (EAAs) and polyunsaturated fatty acids (PUFAs), as well as antioxidant properties including 2,2-diphenyl-1-picrylhydrazyl (DPPH), 2,2-azino-bis (3-ethylbenzthiazoline-6-sulphonic acid) (ABTS) radical scavenging activities, ferric reducing antioxidant power (FRAP) and metal chelating activity in the experimental shrimp paste compared to traditional shrimp paste (p < 0.05). The faster development of some characteristics of inoculated samples were also noted, as indicated by the higher total viable count (TVC), formal and amino nitrogen content, pH, and browning index, as well as biogenic amines, indicating different quality which may be further responsible for different product acceptability. The changes in quality/characteristics of shrimp paste were observed throughout the 18 months of storage. Shrimp paste stored at room temperature accelerated those changes faster than samples stored at low temperature (p < 0.05); however, the quality of them still meets the product’s standard even storage for 18 months. Meanwhile, shrimp paste stored at a low temperature had an amount of yeast and mold over the limitation (>3.00 log CFU/g), indicating food spoilage. Thus, storage at room temperature can extend this product’s shelf-life better than storage at low temperature. Overall, inoculation with B. subtilis K-C3, in conjunction with storage at room temperature, resulted in quality improvement and maintenance in shrimp paste, particularly in the aspects of nutritional profiles and safety concern, as the shrimp paste should have a shelf-life of at least 18 months.
De Novo Transcriptome Analysis of the Early Hybrid Triploid Loach (Misgurnus anguillicaudatus) Provides Novel Insights into Fertility Mechanism
Authors: Zhou Ziyu , Shan Gu , Li Xin , Guo Wenxuan , Ma Kexin , Yang Yueyao , Li Yifan , Zhang Yunbang , Zhou He , Cao Xiaojuan
Published: January 2023

As a new freshwater aquaculture product, triploid loaches (Misgurnus anguillicaudatus) are characterized by fast growth, high-quality meat, high edibility, high resistance to disease, and sterility. In this study, a natural tetraploid loach (4n = 100) (♀) was crossed with a diploid loach (2n = 50) (♂), thus creating the hybrid triploid loach (3n = 75). The histological observations of triploid offspring and diploid controls at 4 days post-hatching (dph), 15dph, 22dph, and 50dph showed that most of the hybrid triploid loaches were abortive in the early gonad differentiation process. To explore its fertility mechanism, through transcriptome analyses of triploid offspring and diploid controls at four periods, 10 differentially expressed genes related to the early fertility mechanism were identified: amh, hormad1, rec8, h2b, plvap, zp3, h2a, nrb0b1, ddx4, and esr2. According to the Kyoto Encyclopedia of Genes and Genomes (KEGG) enrichment analyses of DEGs, two pathways were identified that are closely related to the early fertility mechanism at 50dph: the estrogen signaling pathway and steroid biosynthesis. The findings laid a foundation for further exploration of their molecular inhibition mechanism in hybrid triploid loaches.
Characterization and Application of EST-SSR Markers Developed from Transcriptome Sequences in Elymus breviaristatus (Poaceae: Triticeae)
Authors: Li Jin , Zhang Changbing , Chen Shiyong , Jiang Keke , Guan Hao , Liu Wenhui
Published: January 2023

Background: Elymus L. is the largest genus in the Triticeae tribe. Most species in this genus are highly stress resistant, with excellent forage value. Elymus breviaristatus, a rare species endemic to the Qinghai-Tibet Plateau (QTP), is declining due to habitat fragmentation. However, genetic data for E. breviaristatus are limited, with expressed sequence tag (EST) markers being particularly rare, hampering genetic studies and protection measures. Results: We obtained 9.06 Gb clean sequences from the transcriptome of E. breviaristatus, generating 171,522 unigenes, which were assembled and functionally annotated against five public databases. We identified 30,668 SSRs in the E. breviaristatus transcriptome, from which 103 EST-SSR primer pairs were randomly selected. Of these, 58 pairs of amplified products of the expected size, and 18 of the amplified products were polymorphic. Model-based Bayesian clustering, the unweighted pair group method with arithmetic average (UPGMA), and principal coordinate analysis (PCoA) of 179 wild E. breviaristatus in 12 populations using these EST-SSRs were generally consistent, grouping the 12 populations into two major clades. Analysis of molecular variance (AMOVA) found 70% of the genetic variation among the 12 populations and 30% within the populations, indicating a high level of genetic differentiation (or low gene exchange) among the 12 populations. The transferability of the 58 successful EST-SSR primers to 22 related hexaploid species was 86.2–98.3%. UPGMA analysis generally grouped species with similar genome types together. Conclusions: Here, we developed EST-SSR markers from the transcriptome of E. breviaristatus. The transferability of these markers was evaluated, and the genetic structure and diversity of E. breviaristatus were explored. Our results provide a basis for the conservation and management of this endangered species, and the obtained molecular markers represent valuable resources for the exploration of genetic relationships among species in the Elymus genus.
Knowledge of and Testing Rate for Hepatitis C Infection among the General Public of Saudi Arabia: A Cross-Sectional Study
Authors: Alzahrani Mohammad S. , Ayn Aldeen Abdullah , Almalki Rayan S. , Algethami Mohammed B. , Altowairqi Nawaf F. , Alzahrani Ammar , Almalki Ahmed S. , Alzhrani Rami M. , Algarni Majed A.
Published: January 2023

Introduction: The Ministry of Health in Saudi Arabia has announced a plan to eradicate hepatitis C virus (HCV) infection. This study sought to evaluate the knowledge levels and testing rate among the general population of Saudi Arabia. Methods: A cross-sectional study was conducted using data collected from an online, self-administered survey. Multivariable analysis was conducted using multiple binary logistic regression models to identify factors associated with low knowledge levels as well as predictors of HCV testing. Results: A total of 689 participants completed the survey. While most participants (88%) have heard of HCV infection, less than half (47.3%) understood that HCV is curable with medications. More than half of the participants (53.7%) have low knowledge about HCV infection. Testing for HCV was reported by 123 respondents (17.8%), and the odds of testing for HCV were significantly lower among residents of the Makkah region (OR = 0.59 [95% CI: 0.36–0.97]) and those with low knowledge level (OR = 0.47 [95% CI: 0.29–0.74]). HCV diagnosis was reported by nine respondents (1.3%), of whom only four reported receiving treatment (44%). Conclusions: Our study indicates inadequate knowledge levels and relatively low testing rate. These findings underscore the need for national awareness campaigns and more effective strategies for HCV screening.
Influence of Scoring Systems on Mental Fatigue, Physical Demands, and Tactical Behavior during Soccer Large-Sided Games
Authors: Díaz-García Jesús , Ponce-Bordón José Carlos , Moreno-Gil Abel , Rubio-Morales Ana , López-Gajardo Miguel Ángel , García-Calvo Tomás
Published: January 2023

Constraints are common in soccer training to develop physical, technical-tactical, and mental training concurrently. This study examined how different scoring systems influence physical, tactical, and mental demands during large-sided games in soccer. Eighteen youth-elite male (17.39 ± 1.04 y) soccer players completed three 8 vs. 8 large-sided games where the different score systems were i) official score system (OSS; i.e., 1 goal = 1 goal), ii) double the value of the goal—4 min (DVx4; i.e., 1 goal = 1 goal from 0.00 to 7.59 min, and 1 goal = 2 goals from 8.00 to 12.00 min), and iii) double the value of the goal—8 min (DVx8; i.e., 1 goal = 1 goal from 0.00 to 3.59 min, and 1 goal = 2 goals from 4.00 to 12.00 min). Physical demands and tactical behaviors were recorded during tasks using a global positioning system and video camera. Mental fatigue was recorded pre- and post-task using a visual analogue scale. Also, the ratio of perceived exertion and mental load were recorded after tasks were finished. Results reported the highest values of mental and physical demands in DVx4. Mental fatigue increased during all three large-sided games, although this increase was significantly higher in DVx4 compared with OSS (p = 0.006) and DVx8 (p = 0.027). Tactical behavior showed a trend towards more direct play during DVx4, which was less observed during DVx8, and not at all during OSS. In conclusion, changing the scoring system affects physical, tactical, and mental demands.
The Effects of Nurses’ Perception of the Older Adults and Work Stress on Nursing Competency of Nurses Who Care for Older Adult Patients at General Hospital
Authors: Lee Hwajin , Gu Minkyung , Sok Sohyune
Published: January 2023

The older adult population is rapidly increasing in South Korea, and hospitalization at general hospitals is increasing too. Therefore, nurses working at general hospitals need the nursing competency for older adult patients. The study was conducted to examine the effects of nurses’ perception of the older adults and work stress on the nursing competency of nurses at a general hospital, South Korea. A cross-sectional, descriptive correlational design was employed. Participants were a total of 136 nurses working at a general hospital located in Seoul, South Korea. Measures used in the study were the study participants’ general characteristics survey, Korean version of the Attitude Toward Old People Scale (KAOPS), the work stress scale, and the nursing competency scale. Data were collected from February to March, 2021. The regression model was statistically significant, and the explanatory power of the regression model was 33%. The significant factors affecting nursing competency were education level, perception of the older adults, and work stress. The greatest affecting factor was education level, followed by perception of the older adults and work stress in order. Nurses caring for older adult patients at general hospitals should pay attention to affecting factors to help improve the nursing competency in clinical practice. Managers should improve relevant policies to ensure that nurses have more opportunities to participate in the practical training of older adult care and explore effective training methods to improve the nurses’ perception of older adults.
Closing the Nutrient Loop—The New Approaches to Recovering Biomass Minerals during the Biorefinery Processes
Authors: Constantinescu-Aruxandei Diana , Oancea Florin
Published: January 2023

The recovery of plant mineral nutrients from the bio-based value chains is essential for a sustainable, circular bioeconomy, wherein resources are (re)used sustainably. The widest used approach is to recover plant nutrients on the last stage of biomass utilization processes—e.g., from ash, wastewater, or anaerobic digestate. The best approach is to recover mineral nutrients from the initial stages of biomass biorefinery, especially during biomass pre-treatments. Our paper aims to evaluate the nutrient recovery solutions from a trans-sectorial perspective, including biomass processing and the agricultural use of recovered nutrients. Several solutions integrated with the biomass pre-treatment stage, such as leaching/bioleaching, recovery from pre-treatment neoteric solvents, ionic liquids (ILs), and deep eutectic solvents (DESs) or integrated with hydrothermal treatments are discussed. Reducing mineral contents on silicon, phosphorus, and nitrogen biomass before the core biorefinery processes improves processability and yield and reduces corrosion and fouling effects. The recovered minerals are used as bio-based fertilizers or as silica-based plant biostimulants, with economic and environmental benefits.
The Association between Change in Lifestyle Behaviors and Mental Health Indicators in Immunosuppressed Individuals during the COVID-19 Pandemic
Authors: Zeitoun Tara , Plante Audrey , Sabiston Catherine M. , Dieudé Mélanie , Doré Isabelle
Published: January 2023

Little is known on how changes in lifestyle behaviors affect mental health among immunosuppressed individuals who observed stricter physical and social distancing measures due to higher risk of complications during the COVID-19 pandemic. This study examines the association between changes in moderate-to-vigorous physical activity (MVPA), sedentary time (ST) and sleep duration following COVID-19 outbreak on mental health indicators of immunosuppressed individuals and their relatives. Participants (n = 132) completed an online questionnaire between May and August 2020. Linear regressions were conducted to assess the associations between an increase or decrease in lifestyle behaviors and mental health indicators. Individuals with decreased MVPA and increased ST experienced higher distress, anxiety and depressive symptoms. Those who reported an increase or decrease in sleep had higher levels of stress, distress and depressive symptoms. Decreases in sleep was associated with higher anxiety symptoms. Lifestyle behaviors in the context of a stressful life event such as the COVID-19 pandemic may impact mental health indicators of immunosuppressed individuals and their relatives.
Spent Yeast Waste Streams as a Sustainable Source of Bioactive Peptides for Skin Applications
Authors: Costa Eduardo M. , Oliveira Ana Sofia , Silva Sara , Ribeiro Alessandra B. , Pereira Carla F. , Ferreira Carlos , Casanova Francisca , Pereira Joana O. , Freixo Ricardo , Pintado Manuela E. , Carvalho Ana Paula , Ramos Óscar L.
Published: January 2023

Spent yeast waste streams are a byproduct obtained from fermentation process and have been shown to be a rich secondary source of bioactive compounds such as phenolic compounds and peptides. The latter are of particular interest for skin care and cosmetics as they have been shown to be safe and hypoallergenic while simultaneously being able to exert various effects upon the epidermis modulating immune response and targeting skin metabolites, such as collagen production. As the potential of spent yeast’s peptides has been mainly explored for food-related applications, this work sought to understand if peptide fractions previously extracted from fermentation engineered spent yeast (Saccharomyces cerevisiae) waste streams possess biological potential for skin-related applications. To that end, cytotoxic effects on HaCat and HDFa cells and whether they were capable of exerting a positive effect upon the production of skin metabolites relevant for skin health, such as collagen, hyaluronic acid, fibronectin and elastin, were evaluated. The results showed that the peptide fractions assayed were not cytotoxic up to the highest concentration tested (500 µg/mL) for both cell lines tested. Furthermore, all peptide fractions showed a capacity to modulate the various target metabolites production with an overall positive effect being observed for the four fractions over the six selected targets (pro-collagen IαI, hyaluronic acid, fibronectin, cytokeratin-14, elastin, and aquaporin-9). Concerning the evaluated fractions, the overall best performance (Gpep > 1 kDa) was of an average promotion of 41.25% over the six metabolites and two cell lines assessed at a concentration of 100 µg/mL. These results showed that the peptide fractions assayed in this work have potential for future applications in skin-related products at relatively low concentrations, thus providing an alternative solution for one of the fermentation industry’s waste streams and creating a novel and highly valuable bioactive ingredient with encompassing activity to be applied in future skin care formulations.
Convergent Evolution in SARS-CoV-2 Spike Creates a Variant Soup from Which New COVID-19 Waves Emerge
Authors: Focosi Daniele , Quiroga Rodrigo , McConnell Scott , Johnson Marc C. , Casadevall Arturo
Published: January 2023

The first 2 years of the COVID-19 pandemic were mainly characterized by recurrent mutations of SARS-CoV-2 Spike protein at residues K417, L452, E484, N501 and P681 emerging independently across different variants of concern (Alpha, Beta, Gamma, and Delta). Such homoplasy is a marker of convergent evolution. Since Spring 2022 and the third year of the pandemic, with the advent of Omicron and its sublineages, convergent evolution has led to the observation of different lineages acquiring an additional group of mutations at different amino acid residues, namely R346, K444, N450, N460, F486, F490, Q493, and S494. Mutations at these residues have become increasingly prevalent during Summer and Autumn 2022, with combinations showing increased fitness. The most likely reason for this convergence is the selective pressure exerted by previous infection- or vaccine-elicited immunity. Such accelerated evolution has caused failure of all anti-Spike monoclonal antibodies, including bebtelovimab and cilgavimab. While we are learning how fast coronaviruses can mutate and recombine, we should reconsider opportunities for economically sustainable escape-proof combination therapies, and refocus antibody-mediated therapeutic efforts on polyclonal preparations that are less likely to allow for viral immune escape.
Cell-Molecular Interactions of Nano- and Microparticles in Dental Implantology
Authors: Labis Varvara , Bazikyan Ernest , Demin Denis , Dyachkova Irina , Zolotov Denis , Volkov Alexey , Asadchikov Victor , Zhigalina Olga , Khmelenin Dmitry , Kuptsova Daria , Petrichuk Svetlana , Semikina Elena , Sizova Svetlana , Oleinikov Vladimir , Khaidukov Sergey , Kozlov Ivan
Published: January 2023

The role of metallic nano- and microparticles in the development of inflammation has not yet been investigated. Soft tissue biopsy specimens of the bone bed taken during surgical revisions, as well as supernatants obtained from the surface of the orthopedic structures and dental implants (control), were examined. Investigations were performed using X-ray microtomography, X-ray fluorescence analysis, and scanning electron microscopy. Histological studies of the bone bed tissues were performed. Nanoscale and microscale metallic particles were identified as participants in the inflammatory process in tissues. Supernatants containing nanoscale particles were obtained from the surfaces of 20 units of new dental implants. Early and late apoptosis and necrosis of immunocompetent cells after co-culture and induction by lipopolysaccharide and human venous blood serum were studied in an experiment with staging on the THP-1 (human monocytic) cell line using visualizing cytometry. As a result, it was found that nano- and microparticles emitted from the surface of the oxide layer of medical devices impregnated soft tissue biopsy specimens. By using different methods to analyze the cell–molecule interactions of nano- and microparticles both from a clinical perspective and an experimental research perspective, the possibility of forming a chronic immunopathological endogenous inflammatory process with an autoimmune component in the tissues was revealed.
Enzyme Inhibition-Based Assay to Estimate the Contribution of Formulants to the Effect of Commercial Pesticide Formulations
Authors: Esimbekova Elena N. , Kalyabina Valeriya P. , Kopylova Kseniya V. , Lonshakova-Mukina Victoria I. , Antashkevich Anna A. , Torgashina Irina G. , Lukyanenko Kirill A. , Nemtseva Elena V. , Kratasyuk Valentina A.
Published: January 2023

Pesticides can affect the health of individual organisms and the function of the entire ecosystem. Therefore, thorough assessment of the risks associated with the use of pesticides is a high-priority task. An enzyme inhibition-based assay is used in this study as a convenient and quick tool to study the effects of pesticides at the molecular level. The contribution of formulants to toxicological properties of the pesticide formulations has been studied by analyzing effects of 7 active ingredients of pesticides (AIas) and 10 commercial formulations based on them (AIfs) on the function of a wide range of enzyme assay systems differing in complexity (single-, coupled, and three-enzyme assay systems). Results have been compared with the effects of AIas and AIfs on bioluminescence of the luminous bacterium Photobacterium phosphoreum. Mostly, AIfs produce a considerably stronger inhibitory effect on the activity of enzyme assay systems and bioluminescence of the luminous bacterium than AIas, which confirms the contribution of formulants to toxicological properties of the pesticide formulation. Results of the current study demonstrate that “inert” ingredients are not ecotoxicologically safe and can considerably augment the inhibitory effect of pesticide formulations; therefore, their use should be controlled more strictly. Circular dichroism and fluorescence spectra of the enzymes used for assays do not show any changes in the protein structure in the presence of commercial pesticide formulations during the assay procedure. This finding suggests that pesticides produce the inhibitory effect on enzymes through other mechanisms.
In Vivo and In Silico Analgesic Activity of Ficus populifolia Extract Containing 2-O-β-D-(3′,4′,6′-Tri-acetyl)-glucopyranosyl-3-methyl Pentanoic Acid
Authors: Mohammed Hamdoon A. , Abouzied Amr S. , Mohammed Salman A. A. , Khan Riaz A.
Published: January 2023

Natural product-based structural templates have immensely shaped small molecule drug discovery, and new biogenic natural products have randomly provided the leads and molecular targets in anti-analgesic activity spheres. Pain relief achieved through opiates and non-steroidal anti-inflammatory drugs (NSAIDs) has been under constant scrutiny owing to their tolerance, dependency, and other organs toxicities and tissue damage, including harm to the gastrointestinal tract (GIT) and renal tissues. A new, 3′,4′,6′-triacetylated-glucoside, 2-O-β-D-(3′,4′,6′-tri-acetyl)-glucopyranosyl-3-methyl pentanoic acid was obtained from Ficus populifolia, and characterized through a detailed NMR spectroscopic analysis, i.e., 1H-NMR, 13C-DEPT-135, and the 2D nuclear magnetic resonance (NMR) correlations. The product was in silico investigated for its analgesic prowess, COX-2 binding feasibility and scores, drug likeliness, ADMET (absorption, distribution, metabolism, excretion, and toxicity) properties, possible biosystem’s toxicity using the Discovery Studio®, and other molecular studies computational software programs. The glycosidic product showed strong potential as an analgesic agent. However, an in vivo evaluation, though at strong levels of pain-relieving action, was estimated on the compound’s extract owing to the quantity and yield issues of the glycosidic product. Nonetheless, the F. populifolia extract showed the analgesic potency in eight-week-old male mice on day seven of the administration of the extract’s dose in acetic acid-induced writhing and hot-plate methods. Acetic acid-induced abdominal writhing for all the treated groups decreased significantly (p < 0.0001), as compared to the control group (n = 6) by 62.9%, 67.9%, and 70.9% of a dose of 100 mg/kg (n = 6), 200 mg/kg (n = 6), and 400 mg/kg (n = 6), respectively. Similarly, using the analgesia meter, the reaction time to pain sensation increased significantly (p < 0.0001), as compared to the control (n = 6). The findings indicated peripheral and central-nervous-system-mediated analgesic action of the product obtained from the corresponding extract.
Application of Single-Cell and Spatial Omics in Musculoskeletal Disorder Research
Authors: Feng Site , Li Jiahao , Tian Jingjing , Lu Sheng , Zhao Yu
Published: January 2023

Musculoskeletal disorders, including fractures, scoliosis, heterotopic ossification, osteoporosis, osteoarthritis, disc degeneration, and muscular injury, etc., can occur at any stage of human life. Understanding the occurrence and development mechanism of musculoskeletal disorders, as well as the changes in tissues and cells during therapy, might help us find targeted treatment methods. Single-cell techniques provide excellent tools for studying alterations at the cellular level of disorders. However, the application of these techniques in research on musculoskeletal disorders is still limited. This review summarizes the current single-cell and spatial omics used in musculoskeletal disorders. Cell isolation, experimental methods, and feasible experimental designs for single-cell studies of musculoskeletal system diseases have been reviewed based on tissue characteristics. Then, the paper summarizes the latest findings of single-cell studies in musculoskeletal disorders from three aspects: bone and ossification, joint, and muscle and tendon disorders. Recent discoveries about the cell populations involved in these diseases are highlighted. Furthermore, the therapeutic responses of musculoskeletal disorders, especially single-cell changes after the treatments of implants, stem cell therapies, and drugs are described. Finally, the application potential and future development directions of single-cell and spatial omics in research on musculoskeletal diseases are discussed.
Primitive Oligomeric RNAs at the Origins of Life on Earth
Authors: Demongeot Jacques , Thellier Michel
Published: January 2023

There are several theories on the origin of life, which differ by choosing the preponderant factor of emergence: main function (autocatalysis versus replication), initial location (black smokers versus ponds) or first molecule (RNA versus DNA). Among the two last ones, the first assumes that an RNA world involving a collaboration of small RNAs with amino-acids pre-existed and the second that DNA–enzyme–lipid complexes existed first. The debate between these classic theories is not closed and the arguments for one or the other of these theories have recently fueled a debate in which the two have a high degree of likelihood. It therefore seems interesting to propose a third intermediate way, based on the existence of an RNA that may have existed before the latter stages postulated by these theories, and therefore may be the missing link towards a common origin of them. To search for a possible ancestral structure, we propose as candidate a small RNA existing in ring or hairpin form in the early stages of life, which could have acted as a “proto-ribosome” by favoring the synthesis of the first peptides. Remnants of this putative candidate RNA exist in molecules nowadays involved in the ribosomal factory, the concentrations of these relics depending on the seniority of these molecules within the translation process.
Biodegradable Guar-Gum-Based Super-Porous Matrices for Gastroretentive Controlled Drug Release in the Treatment of Helicobacter pylori: A Proof of Concept
Authors: Grosso Roberto , Benito Elena , Carbajo-Gordillo Ana I. , García-Martín M. Gracia , Perez-Puyana Víctor , Sánchez-Cid Pablo , de-Paz M.-Violante
Published: January 2023

An increase in resistance to key antibiotics has made the need for novel treatments for the gastric colonization of Helicobacter pylori (H. pylori) a matter of the utmost urgency. Recent studies tackling this topic have focused either on the discovery of new compounds to ameliorate therapeutic regimes (such as vonoprazan) or the synthesis of gastroretentive drug delivery systems (GRDDSs) to improve the pharmacokinetics of oral formulations. The use of semi-interpenetrating polymer networks (semi-IPNs) that can act as super-porous hydrogels for this purpose is proposed in the present work, specifically those displaying low ecological footprint, easy synthesis, self-floating properties, high encapsulation efficiency for drugs such as amoxicillin (AMOX), great mucoadhesiveness, and optimal mechanical strength when exposed to stomach-like fluids. To achieve such systems, biodegradable synthetic copolymers containing acid-labile monomers were prepared and interpenetrated with guar gum (GG) in a one-pot polymerization process based on thiol-ene click reactions. The resulting matrices were characterized by SEM, GPC, TGA, NMR, and rheology studies, and the acidic hydrolysis of the acid-sensitive polymers was also studied. Results confirm that some of the obtained matrices are expected to perform optimally as GRDDSs for the sustained release of active pharmaceutical ingredients at the gastrointestinal level, being a priori facilitated by its disaggregation. Therefore, the optimal performance of these systems is assessed by varying the molar ratio of the labile monomer in the matrices.
Variability of Low-Z Inhomogeneity Correction in IMRT/SBRT: A Multi-Institutional Collaborative Study
Authors: Yadav Poonam , DesRosiers Colleen M. , Mitra Raj K. , Srivastava Shiv P. , Das Indra J.
Published: January 2023

Dose-calculation algorithms are critical for radiation treatment outcomes that vary among treatment planning systems (TPS). Modern algorithms use sophisticated radiation transport calculation with detailed three-dimensional beam modeling to provide accurate doses, especially in heterogeneous medium and small fields used in IMRT/SBRT. While the dosimetric accuracy in heterogeneous mediums (lung) is qualitatively known, the accuracy is unknown. The aim of this work is to analyze the calculated dose in lung patients and compare the validity of dose-calculation algorithms by measurements in a low-Z phantom for two main classes of algorithms: type A (pencil beam) and type B (collapse cone). The CT scans with volumes (target and organs at risk, OARs) of a lung patient and a phantom build to replicate the human lung data were sent to nine institutions for planning. Doses at different depths and field sizes were measured in the phantom with and without inhomogeneity correction across multiple institutions to understand the impact of clinically used dose algorithms. Wide dosimetric variations were observed in target and OAR coverage in patient plans. The correction factor for collapsed cone algorithms was less than pencil beam algorithms in the small fields used in SBRT. The pencil beam showed ≈70% variations between measured and calculated correction factors for various field sizes and depths. For large field sizes the trends of both types of algorithms were similar. The differences in measured versus calculated dose for type-B algorithms were within ±10%. Significant variations in the target and OARs were observed among various TPS. The results suggest that the pencil beam algorithm does not provide an accurate dose and should not be considered with small fields (IMRT/SBRT). Type-B collapsed-cone algorithms provide better agreement with measurements, but still vary among various systems.
Effect of Heat Treatment on Osteoblast Performance and Bactericidal Behavior of Ti6Al4V(ELI)-3at.%Cu Fabricated by Laser Powder Bed Fusion
Authors: Martín Vilardell Anna , Cantillo Alzamora Vanesa , Bauso Luana Vittoria , Madrid Cristina , Krakhmalev Pavel , Albu Mihaela , Yadroitsava Ina , Yadroitsev Igor , Garcia-Giralt Natalia
Published: January 2023

Cu addition to alloys for biomedical applications has been of great interest to reduce bacterial growth. In situ-alloyed Ti6Al4V(ELI)-3at.%Cu was successfully manufactured by laser powder bed fusion (L-PBF). Even so, post-heat treatments are required to avoid distortions and/or achieve required/desired mechanical and fatigue properties. The present study is focused on the investigation of microstructural changes in L-PBF Ti6Al4V(ELI)-3at.%Cu after stress relieving and annealing treatments, as well as their influence on osteoblast and bactericidal behavior. After the stress relieving treatment, a homogenously distributed β phase and CuTi2 intermetallic precipitates were observed over the αʹ matrix. The annealing treatment led to the increase in amount and size of both types of precipitates, but also to phase redistribution along α lamellas. Although microstructural changes were not statistically significant, such increase in β and CuTi2 content resulted in an increase in osteoblast proliferation after 14 days of cell culture. A significant bactericidal behavior of L-PBF Ti6Al4V(ELI)-3at.%Cu by means of ion release was found after the annealing treatment, provably due to the easier release of Cu ions from β phase. Biofilm formation was inhibited in all on Cu-alloyed specimens with stress relieving but also annealing treatment.
Monitoring Non-Indigenous Species with Passive Sampling Methods in an Oceanic Island
Authors: Diem Anna , Ramalhosa Patrício , Cacabelos Eva , Ferrario Jasmine , Castro Nuno , Henriques Filipe , Monteiro João Gama , Chainho Paula , Pham Christopher Kim , Canning-Clode João , Paula José , Gestoso Ignacio
Published: January 2023

The synergistic effects of biological invasions have long been considered significant causes of biodiversity loss worldwide. Therefore, early detection monitoring is crucial in mitigating nonindigenous species (NIS) threats. In the marine environment, settlement plates were used as monitoring devices in ports, but this method was mainly applied to assess the sessile benthic community and is less efficient in collecting the mobile biota and accessing its diversity. Moreover, as the potential expansion of NIS to the surrounding coastal environment is still poorly understood, a pilot study was conducted focusing on two aspects: (i) improving the feasibility of the settling method under different environmental contexts and (ii) enhancing the capacity of the developed prototypes to collect more representative samples (i.e., sessile and mobile biota). Three different prototypes were designed: a box prototype consisting of PVC plates encapsulated by a plastic bottle, a CD prototype with CDs surrounded by a net, and a PVC prototype with uncovered PVC plates. The prototypes were deployed inside a marina and in an outside area on Madeira Island, Portugal. Results indicate that the PVC prototype was the most efficient regarding monitoring the sessile community, whereas the box prototype showed the highest abundance of the mobile fauna. The location influenced both the sessile community composition and the number of mobile taxa. Our findings suggest combining features from prototypes to encompass the whole benthic community better.
Development of Diagnostic Markers and Applied for Genetic Diversity Study and Population Structure of Bipolaris sorokiniana Associated with Leaf Blight Complex of Wheat
Authors: Kashyap Abhijeet Shankar , Manzar Nazia , Maurya Avantika , Mishra Deendayal Das , Singh Ravinder Pal , Sharma Pawan Kumar
Published: January 2023

Bipolaris sorokiniana, a key pathogenic fungus in the wheat leaf blight complex, was the subject of research that resulted in the development of fifty-five polymorphic microsatellite markers. These markers were then used to examine genetic diversity and population structure in Indian geographical regions. The simple sequence repeat (SSR) like trinucleotides, dinucleotides, and tetranucleotides accounted for 43.37% (1256), 23.86% (691), and 16.54% (479) of the 2896 microsatellite repeats, respectively. There were 109 alleles produced by these loci overall, averaging 2.36 alleles per microsatellite marker. The average polymorphism information content value was 0.3451, with values ranging from 0.1319 to 0.5932. The loci’s Shannon diversity varied from 0.2712 to 1.2415. These 36 isolates were divided into two main groups using population structure analysis and unweighted neighbour joining. The groupings were not based on where the isolates came from geographically. Only 7% of the overall variation was found to be between populations, according to an analysis of molecular variance. The high amount of gene flow estimate (NM = 3.261 per generation) among populations demonstrated low genetic differentiation in the entire populations (FST = 0.071). The findings indicate that genetic diversity is often minimal. In order to examine the genetic diversity and population structure of the B. sorokiniana populations, the recently produced microsatellite markers will be helpful. This study’s findings may serve as a foundation for developing improved management plans for the leaf blight complex and spot blotch of wheat diseases in India.
Cis-(3-benzyloxy-1,1-cyclobutanedicarboxylato κ2O,O′)bis(1-methyl-1H-pyrazole)platinum(II)
Authors: Pavlova Anna S. , Buslaev Daniil A. , Borisova Nataliya E. , Temnov Victor V. , Nazarov Alexey A. , Podrugina Tatyana A.
Published: January 2023

A huge variety of types of cancer makes it necessary to search for new effective drugs with a defined molecular target. Modification of substituents in ligands based on 3-hydroxy-1,1-cyclobutanedicarboxylic acid are one of the effective directions to design a better version of carboplatin. In the present study, we combined in one molecule a derivative of 3-hydroxycyclobutane-1,1-dicarboxylic acid and N-methylpyrazole as a carrier ligand. The antiproliferative of the novel complex Pt(II) was established for cell lines HCT116, MCF7, A549, and WI38 by means of a standard MTT colorimetric assay.
(4-(Adamantan-1-yl)-1-(isopropyl)-1H-imidazol-2-yl)methanol
Authors: Gaynor Ryan B. , McIntyre Baylee N. , Creutz Sidney E.
Published: January 2023

(4-(Adamantan-1-yl)-1-(isopropyl)-1H-imidazol-2-yl)methanol was prepared through a five-step process starting from commercially available 1-acetyladamantane. Each step proceeded in moderate-to-excellent yields and the overall yield across five steps was 28%. The compound was identified and characterized by 1H and 13C{1H} NMR, high-resolution mass spectroscopy, and elemental analysis. This compound and its derivatives have the potential to be used as precursors to the synthesis of biomimetic chelating ligands.
Laser-Assisted Robotic Roller Forming of Ultrahigh-Strength Steel QP1180 with High Precision
Authors: Min Junying , Wang Jincheng , Lian Junhe , Liu Yi , Hou Zeran
Published: January 2023

Laser-assisted forming provides a perfect solution that overcomes the formability of low-ductility materials. In this study, laser-assisted robotic roller forming (LRRF) was applied to bend ultrahigh-strength steel sheet (a quenching and partitioning steel with a strength grade of 1180 MPa), and the effects of laser power density on the bending forces, springback, and bending radius of the final parts were investigated. The results show that LRRF is capable of reducing bending forces by 43%, and a compact profile with high precision (i.e., a springback angle smaller than 1° and a radius-to-thickness ratio of ~1.2) was finally achieved at a laser power density of 10 J/mm2. A higher forming temperature, at which a significant decrease in strength is observed, is responsible for the decrease of forming forces with a laser power density of higher than 7.5 J/mm2; another reason could be the heating-to-austenitization temperature and subsequent forming at a temperature above martensitic-transformation temperature. Forming takes place at a higher temperature with lower stresses, and unloading occurs at a relatively lower temperature with the recovery of Young’s modulus; both facilitate the reduction of springback angles. In addition, the sharp bending radius is considered to be attributed to localized deformation and large plastic strains at the heating area.