bluuebunny/crossref_metadata_2025 huggingface dataset:
Characterization and Geomorphic Change Detection of Landslides Using UAV Multi-Temporal Imagery in the Himalayas, Pakistan
Authors: Ahmad Naseem , Shafique Muhammad , Hussain Mian Luqman , Islam Fakhrul , Tariq Aqil , Soufan Walid
Published: June 2024

Multi-temporal unmanned aerial vehicle (UAV) imagery and topographic data were used to characterize and evaluate the geomorphic changes of two active landslides (Nara and Nokot) in Pakistan. Ortho-mosaic images and field-based investigations were utilized to assess the geomorphological changes, including the Topographic Wetness Index, slope, and displacement. Volumetric changes in specific areas of the landslides were measured using the Geomorphic Change Detection (GCD) tool. The depletion zone of the Nara landslide was characterized by failures of the main scarps, resulting in landslides causing erosional displacements exceeding 201.6 m. In contrast, for the Nokot landslide, the erosional displacement ranged from −201.05 m to −64.98 m. The transition zone of the slide experienced many slow earth flows that re-mobilized displaced material from the middle portion of the landslide, ultimately reaching the accumulation zone. Volumetric analysis of the Nara landslide indicated overall erosion of landslide material with a volume of approximately 4,565,274.96 m3, while the accumulated and surface-raising material volume was approximately 185,544.53 m3. Similarly, for the Nokot landslide, the overall erosion of landslide material was estimated to be 6,486,121.30 m3, with an accumulated volume and surface-raising material of 117.98 m3. This study has demonstrated the efficacy of the GCD tool as a robust and repeatable method for mapping and monitoring landslide dynamics with UAVs over a relatively long time series.
Land Transfer Contract and Farmers’ Straw-Returning Behavior: Evidence from Rural China
Authors: Li Ruisheng , Huang Bin , Liu Shaoquan , Xu Dingde
Published: June 2024

Straw return is a crucial method for utilizing agricultural waste as a resource. Against the backdrop of increasing straw production in China, most scholars focus only on the behavioral decision of whether farmers choose to transfer land. However, few studies have touched on the specific content of the land transfer contract and its impact on farmers’ behavior. This paper innovatively starts from the perspective of land transfer contracts to explore the impact of land transfer contracts on straw return in terms of standardization, stability, and profitability and to make theoretical contributions to the rational use of straw and the protection of arable land resources. Using data from the 2020 China Rural Revitalization Survey (CRRS) database, this study empirically analyzed the effects of different elements of land transfer contracts on straw returns to the field. The results show that: (1) Written transfer contracts are more effective than verbal contracts in encouraging farmers to adopt the straw return behavior. (2) Fixed-term contracts are more stable and can effectively promote farmers’ adoption of straw return technology. (3) The remunerative transfer method is more profitable and can effectively encourage farmers to adopt straw return technology compared to the non-remunerative transfer method. (4) Farmers in mountainous areas or with smaller areas of farmland have a lower probability of adopting straw return technology. Therefore, the important role of remunerative, fixed-term, written land transfer contracts in the process of straw return should be emphasized, and the adoption rate of straw return should be increased through differentiated policy guidance and comprehensively promoting the sustainable development of agriculture.
Decellularized Wharton’s Jelly and Amniotic Membrane Demonstrate Potential Therapeutic Implants in Tracheal Defects in Rabbits
Authors: Neto Aloysio Enck , Foltz Katia Martins , Fuchs Thiago , Gamba Luize Kremer , Denk Marcos Antonio , Silveira Paulo Cesar Lock , Nascimento Thatyanne Gradowski do , Clemencia Alice Machado , Francisco Julio César , Noronha Lucia de , Guarita-Souza Luiz César
Published: June 2024

Background: Tracheal grafts have been investigated for over a century, aiming to replace various lesions. However, tracheal reconstruction surgery remains a challenge, primarily due to anatomical considerations, intraoperative airway management, the technical complexity of reconstruction, and the potential postoperative morbidity and mortality. Due to research development, the amniotic membrane (AM) and Wharton’s Jelly (WJ) arise as alternatives within the new set of therapeutic alternatives. These structures hold significant therapeutic potential for tracheal defects. This study analyzed the capacity of tracheal tissue regeneration after 60 days of decellularized WJ and AM implantation in rabbits submitted to conventional tracheostomy. Methods: An in vivo experimental study was carried out using thirty rabbits separated into three groups (Control, AM, and WJ) (n = 10). The analyses were performed 60 days after surgery through immunohistochemistry. Results: Different immunomarkers related to scar regeneration, such as aggrecan, TGF-β1, and α-SMA, were analyzed. However, they highlighted no significant difference between the groups. Collagen type I, III, and Aggrecan also showed no significant difference between the groups. Conclusions: Both scaffolds appeared to be excellent frameworks for tissue engineering, presenting biocompatibility and a desirable microenvironment for cell survival; however, they did not display histopathological benefits in trachea tissue regeneration.
Towards Improved XAI-Based Epidemiological Research into the Next Potential Pandemic
Authors: Khalili Hamed , Wimmer Maria A.
Published: June 2024

By applying AI techniques to a variety of pandemic-relevant data, artificial intelligence (AI) has substantially supported the control of the spread of the SARS-CoV-2 virus. Along with this, epidemiological machine learning studies of SARS-CoV-2 have been frequently published. While these models can be perceived as precise and policy-relevant to guide governments towards optimal containment policies, their black box nature can hamper building trust and relying confidently on the prescriptions proposed. This paper focuses on interpretable AI-based epidemiological models in the context of the recent SARS-CoV-2 pandemic. We systematically review existing studies, which jointly incorporate AI, SARS-CoV-2 epidemiology, and explainable AI approaches (XAI). First, we propose a conceptual framework by synthesizing the main methodological features of the existing AI pipelines of SARS-CoV-2. Upon the proposed conceptual framework and by analyzing the selected epidemiological studies, we reflect on current research gaps in epidemiological AI toolboxes and how to fill these gaps to generate enhanced policy support in the next potential pandemic.
The Role of Grifola frondosa Polysaccharide in Preventing Skeletal Muscle Atrophy in Type 2 Diabetes Mellitus
Authors: She Ying , Ma Yun , Zou Pei , Peng Yang , An Yong , Chen Hang , Luo Peng , Wei Shaofeng
Published: June 2024

Type 2 diabetes mellitus (T2DM) is a burgeoning public health challenge worldwide. Individuals with T2DM are at increased risk for skeletal muscle atrophy, a serious complication that significantly compromises quality of life and for which effective prevention measures are currently inadequate. Emerging evidence indicates that systemic and local inflammation stemming from the compromised intestinal barrier is one of the crucial mechanisms contributing to skeletal muscle atrophy in T2DM patients. Notably, natural plant polysaccharides were found to be capable of enhancing intestinal barrier function and mitigating secondary inflammation in some diseases. Herein, we hypothesized that Grifola frondosa polysaccharide (GFP), one of the major plant polysaccharides, could prevent skeletal muscle atrophy in T2DM via regulating intestinal barrier function and inhibiting systemic and local inflammation. Using a well-established T2DM rat model, we demonstrated that GFP was able to not only prevent hyperglycemia and insulin resistance but also repair intestinal mucosal barrier damage and subsequent inflammation, thereby alleviating the skeletal muscle atrophy in the T2DM rat model. Additionally, the binding free energy analysis and molecular docking of monosaccharides constituting GFP were further expanded for related targets to uncover more potential mechanisms. These results provide a novel preventative and therapeutic strategy for T2DM patients.
2-{(E)-{{(R)-1-[(1R,5S,6R)-3,3-Dimethyl-2,4,7-trioxabicyclo[3.3.0]octan-6-yl]ethyl}imino}methyl}-6-{[(diphenylphosphino)oxy] phenyl}palladium(II) chloride
Authors: Guillarme Stéphane , Saluzzo Christine
Published: June 2024

An unsymmetrical PCN palladium pincer complex 2-{(E)-{{(R)-1-[(1R,5S,6R)-3,3-dimethyl-2,4,7-trioxabicyclo[3.3.0]octan-6-yl]ethyl}imino}methyl}-6-{[(diphenylphosphino)oxy] phenyl}palladium(II) chloride based on an iminophosphinite ligand bearing two fused five-membered cycles, one of which containing a THF ring, was prepared in an eight-reaction sequence from a sustainable and enantiopure starting material, isosorbide, in a 20% overall yield.
Constructing Stiff β-Sheet for Self-Reinforced Alginate Fibers
Authors: Xie Xuelai , Cui Min , Wang Tianyuan , Yang Jinhong , Li Wenli , Wang Kai , Lin Min
Published: June 2024

The application of alginate fibers is limited by relatively low mechanical properties. Herein, a self-reinforcing strategy inspired by nature is proposed to fabricate alginate fibers with minimal changes in the wet-spinning process. By adapting a coagulation bath composing of CaCl2 and ethanol, the secondary structure of sodium alginate (SA) was regulated during the fibrous formation. Ethanol mainly increased the content of β-sheet in SA. Rheological analysis revealed a reinforcing mechanism of stiff β-sheet for enhanced modulus and strength. In combination with Ca2+ crosslinking, the self-reinforced alginate fibers exhibited an increment of 39.0% in tensile strength and 71.9% in toughness. This work provides fundamental understanding for β-sheet structures in polysaccharides and a subsequent self-reinforcing mechanism. It is significant for synthesizing strong and tough materials. The self-reinforcing strategy involved no extra additives and preserved the degradability of the alginate. The reinforced alginate fibers exhibited promising potentials for biological applications.
The Influence of Functional Composite Coatings on the Properties of Polyester Films before and after Accelerated UV Aging
Authors: Mizielińska Małgorzata , Zdanowicz Magdalena , Tarnowiecka-Kuca Alicja , Bartkowiak Artur
Published: June 2024

The aim of this study was to cover biopolymeric packaging films based on PLA/PHBV blend with a functional composite coating (to retain their ecological character) and to investigate their antimicrobial properties before and after UV irradiation. As an active coating, the carrier hydroxypropyl methyl cellulose (HPMC), as well as its modified form with Achillea millefolium L., Hippophae rhamnoides L., and Hypericum L. extract (E) and a combined system based on the extracts and nano-ZnO (EZ), was used to obtain active formulations. Additionally, film surface morphology (SEM, FTIR-ATR) and color (CIELab scale) analysis of the pre- and post-UV-treatment samples were performed. The results confirmed that the E and EZ-modified films exhibited antibacterial properties, but they were not effective against phage phi6. Q-SUN irradiation led to a decrease in the activity of E coating against Staphylococcus aureus, Pseudomonas syringae, and Candida albicans. In this case, the effectiveness of EZ against C. albicans at 24 h and 72 h UV irradiation decreased. However, the irradiation boosted the antiviral effectiveness of the EZ layer. SEM micrographs of the film surface showed that UV treatment did not significantly influence the native film morphology, but it had an impact on the coated film. FTIR analysis results showed that the coatings based on HPMC altered the IR absorption of the nonpolar groups of the biopolyester material. The applied coatings only marginally affected film color changes and increased their yellowness after UV irradiation, whereas a composite layer of nano-ZnO limited these changes.
Properties and Applications of Iron–Chalcogenide Superconductors
Authors: Zhao Jianlong , Liao Junsong , Dong Chiheng , Wang Dongliang , Ma Yanwei
Published: June 2024

Iron–chalcogenide superconductors continue to captivate researchers due to their diverse crystalline structures and intriguing superconducting properties, positioning them as both a valuable platform for theoretical investigations and promising candidates for practical applications. This review begins with a comprehensive overview of the fabrication techniques employed for various iron–chalcogenide superconductors, accompanied by a summary of their phase diagrams. Subsequently, it delves into the upper critical field, anisotropy, and critical current density. Furthermore, it discusses the successful fabrication of meters-long coated conductors and explores their applications in superconducting radio-frequency cavities and coils. Finally, several prospective avenues for future research are proposed.
Image Text Extraction and Natural Language Processing of Unstructured Data from Medical Reports
Authors: Malashin Ivan , Masich Igor , Tynchenko Vadim , Gantimurov Andrei , Nelyub Vladimir , Borodulin Aleksei
Published: June 2024

This study presents an integrated approach for automatically extracting and structuring information from medical reports, captured as scanned documents or photographs, through a combination of image recognition and natural language processing (NLP) techniques like named entity recognition (NER). The primary aim was to develop an adaptive model for efficient text extraction from medical report images. This involved utilizing a genetic algorithm (GA) to fine-tune optical character recognition (OCR) hyperparameters, ensuring maximal text extraction length, followed by NER processing to categorize the extracted information into required entities, adjusting parameters if entities were not correctly extracted based on manual annotations. Despite the diverse formats of medical report images in the dataset, all in Russian, this serves as a conceptual example of information extraction (IE) that can be easily extended to other languages.
Can Older Adult Patients with Hip Fractures Have Their Discharge Destination Predicted by Physical Performance Measures?
Authors: Seok Min-A , Choi Jun-Hwan , Roh Young-Ho , Lee So-Young , Lee Hyun-Jung
Published: June 2024

Background and Objectives: The majority of patients who undergo hip fracture surgery do not recover their former level of physical function; hence, it is essential to establish a specific rehabilitation strategy for maximal functional recovery of patients after a hip fracture. Knowing which indicators of physical function in hip fracture patients have a significant impact on the decision regarding the place or timing of discharge would make it possible to plan and prepare for discharge as soon as possible. Therefore, this study aimed to investigate the relationship between physical function and discharge destination for older adult patients with hip fracture. Materials and Methods: In this retrospective cohort study, 150 hip fracture patients (mean age 78.9 ± 10.6 years) between January 2019 and June 2021 were enrolled. Patients were categorized into two groups according to their discharge destination, either home or facility. Demographic and disease-related characteristic data were collected from the medical records. All the patients completed performance-based physical function tests including the 10 Meter Walk Test (10MWT), Timed Up and Go test (TUG), Koval’s grade, and Berg Balance Scale (BBS) at the start of rehabilitation and at discharge. A backward stepwise binary logistic regression analysis was then performed to determine the independent factors of the discharge destination. Results: The home discharge group had a significantly lower Koval’s grade, lower TUG, higher BBS both at baseline and discharge, and younger age. Backward stepwise logistic binary regression analysis showed that TUG, BBS, and 10MWT at baseline and discharge were significant variables affecting the discharge destination after hip fracture. Conclusions: These results demonstrate that balance and gait in older adult patients with hip fractures are highly influential factors in the determining the discharge destination.
High Prevalence of Colistin-Resistant Encoding Genes Carriage among Patients and Healthy Residents in Vietnam
Authors: Le Viet Ha , Khong Thi Diep , Phan Ngoc Quang , Tran Thi Hoa , Vu Hong Ngoc , Van Quyen Dong , Hoang Van Thuan , Nguyen Nam Thang
Published: June 2024

Background and Objectives: We aimed to investigate the carriage of colistin-resistant genes among both patients with a history of antibiotic exposure and apparently healthy adults with no recent healthcare contact. Materials and Methods: Stool swabs were collected from healthy people, and specimens were collected at the infection foci from the patients. Eleven primer/probe sets were used to perform the Multiplex Real-Time PCR assay with the QuantiNova Multiplex Probe PCR kit for screening the carriage of colistin-resistant genes (mcr-1 to mcr-10) and 16S rRNA gene as internal control. Results: In total, 86 patients and 96 healthy residents were included. Twenty two patients (25.9%) were positive with at least one colistin-resistance encoding gene. The mcr-1 gene was the most frequent (16.5%), followed by mcr-9, mcr-6, and mcr-4 genes, where the prevalence was 11.8%, 10.6%, and 9.4%, respectively. No patient was positive with mcr-3, mcr-7, and mcr-8 genes. Eight patients (9.4%) were positive with multiple colistin-encoding genes. Twenty-three healthy people (24.0%) were positive with at least one colistin-resistance encoding gene, and the mcr-10 gene was the most frequent (27.0%), followed by the mcr-1, mcr-8, and mcr-9 genes, where the prevalence was 24.3%, 21.6%, and 13.5%, respectively. No person was positive with the mcr-2 and mcr-5 genes. Conclusions: Our findings underscore the urgent need for enhanced surveillance, infection control measures, and stewardship interventions to mitigate the spread of colistin resistance in Vietnam.
Study on the Recognition of Metallurgical Graphs Based on Deep Learning
Authors: Zhao Qichao , Kang Jinwu , Wu Kai
Published: June 2024

Artificial intelligence has been widely applied in image recognition and segmentation, achieving significant results. However, its application in the field of materials science is relatively limited. Metallography is an important technique for characterizing the macroscopic and microscopic structures of metals and alloys. It plays a crucial role in correlating material properties. Therefore, this study investigates the utilization of deep learning techniques for the recognition of metallo-graphic images. This study selected microscopic images of three typical cast irons, including ductile, gray, and white ones, and another alloy, cast aluminum alloy, from the ASM database for recognition investigation. These images were cut and enhanced for training. In addition to coarse classification of material type, fine classification of material type, composition, and the conditions of image acquisition such as microscope, magnification, and etchant was performed. The MobileNetV2 network was adopted as the model for training and prediction, and ImageNet was used as the dataset for pre-training to improve the accuracy. The metallographic images could be classified into 15 categories by the trained neural networks. The accuracy of validation and prediction for fine classification reached 94.44% and 93.87%, respectively. This indicates that neural networks have the potential to identify types of materials with details of microscope, magnification, etchants, etc., supplemental to compositions for metallographic images.
Application of an Artificial Neural Network for Efficient Computation of Chemical Activities within an EAF Process Model
Authors: Reinicke Alexander , Engbrecht Til-Niklas , Schüttensack Lilly , Echterhof Thomas
Published: June 2024

The electric arc furnace (EAF) is considered the second most important process for the production of crude steel and is usually used for the melting of scrap. With the current emphasis on defossilization, its share in global steelmaking is likely to further increase. Due to the large production quantities, minor improvements to the EAF process can still accumulate into a significant reduction in overall energy and resource consumption. A major aspect in the efficient operation of the EAF is achieving beneficial slag properties, as the slag influences the composition of the steel and can reduce energy losses as well as the maintenance cost. In order to investigate the EAF operation, a dynamic process model is applied. Within the model, the chemical reactions of the metal–slag system are calculated based on the activities of the involved species. In this regard, multiple models for the calculation of the chemical activities have been implemented. However, depending on the chosen model, the computation of the slag activities can be computationally demanding. For this reason, the application of a neural network for the calculation of the chemical activities within the slag is investigated. The performance of the neural network is then compared to the results of the previously applied models by using the commercial software FactSage as a reference. The validation shows that the surrogate model achieves great accuracy while keeping the computation demand low.
Preparation of Antimony Tin Oxide Thin Film Using Green Synthesized Nanoparticles by E-Beam Technique for NO2 Gas Sensing
Authors: Chandraiah Chaitra , Kalpana Hullekere Mahadevaiah , Ananda Challaghatta Muniyappa , Kulkarni Madhusudan B.
Published: June 2024

This work delves into the preparation of ATO thin films and their characterization, fabrication, and calibration of a NO2 gas sensor, as well as the development of the packaged sensor. ATO thin films were prepared by e-beam evaporation using green synthesized ATO nanomaterials on different substrates and annealed at 500 and 600 °C for one hour. The structural and morphological properties of the developed thin films were studied using scanning electron microscopy (SEM), transmission electron microscopy (TEM), and X-ray diffraction (XRD) techniques. An orthorhombic SnO2 crystal structure was recognized through XRD analysis. The granular-shaped nanoparticles were revealed through SEM and TEM images. The films annealed at 600 °C exhibited improved crystallinity. ATO films prepared on normal 5 µm interdigitated electrodes (IDEs) and annealed at 600 °C exhibited a response of 10.31 ± 0.25 with an optimum temperature of 200 °C for a 4.8 ppm NO2 gas concentration. The packaged NO2 gas sensor developed using IDEs with a microheater demonstrated an improved response of 16.20 ± 0.25 for 4.8 ppm of NO2 gas.
Xylella fastidiosa Dispersion on Vegetal Hosts in Demarcated Zones in the North Region of Portugal
Authors: Loureiro Talita , Serra Luís , Martins Ângela , Cortez Isabel , Poeta Patrícia
Published: June 2024

The detection of Xylella fastidiosa in Portugal occurred through prospection in 2019 in Vila Nova de Gaia, Porto, in plants of Lavandula dentata L. Currently, in Portugal, there are 18 Xylella fastidiosa Demarcated Zones (DZs). The main objective of this study is to gain a comprehensive understanding of this problem within the defined Demarcated Zones in the North Region of Portugal from 2019 to June 2023. This work comprised two phases: the prospection phase (inspecting plants, sampling, and submission of samples to the laboratory) and the research phase (collecting and organizing data and statistical treatment). Our findings provide essential insights, suggesting that the Northern Region of Portugal is highly conducive to Xylella fastidiosa. Portugal has Xf-preferred hosts such as the olive tree, orange tree, Laurus nobilis, Rosa spp., Nerium oleander L., Pelargonium sp., Hedera helix L., and Lavandula dentata L. Portugal’s favorable environmental factors such as temperature and humidity can have an important role in influencing the interaction between bacteria and hosts. Nevertheless, it is crucial to consider variations in the behavior of insect vectors, as these variations can limit the prevalence of the disease. Activities like the transport of infected planting materials from the first Demarcated Zone of the Area Metropolitana do Porto could be associated with the introduction and spread of Xylella fastidiosa, potentially triggering new disease outbreaks in the country. Our findings confirm the alarming spread of Xylella fastidiosa across Portugal. Factors such as the presence of insect vectors, abundance of host plants, and climate suitability play pivotal roles in Xylella fastidiosa dispersal. We recommend that countries identified with relatively high risk, like Portugal, undertake thorough individual risk analyses. The implementation of preventive measures and, if necessary, the enhancement of surveillance systems for early detection of Xylella fastidiosa in plants and insect vectors are crucial steps.
Application of a Multi-Technique Approach to the Identification of Mineral Polymorphs in Histological Samples: A Case of Combined Use of SEM/EDS and Micro-Raman Spectroscopy
Authors: Croce Alessandro , Bellis Donata , Rinaudo Caterina , Cagna Laura , Gatti Giorgio , Roveta Annalisa , Bertolotti Marinella , Maconi Antonio
Published: June 2024

In the last few years, an increasing interest has developed regarding the application of different techniques for the identification of pollutants inside the tissues deriving from patients affected by benign or neoplastic diseases. Particular attention was paid to neoplasia linked to particular exposures, e.g., heavy metals, carbon dusts, silica, asbestos. As regards the last pollutant, a wide body of scientific literature has been collected, considering the severe effects caused by mineral fibers on human health. Optical and electronic microscopies were widely applied to identify the fibers in respiratory and extra-respiratory organs to detect the minerals and to link their presence to an exposure source and to understand their role in cancer development. The main advantage of electron microscopy lies in the possibility of coupling the microscopes with energy dispersive spectrometers and also collecting data on the elemental composition of various inorganic phases. In term of sample preparation and time of analysis, the most utilized microscope technique is Scanning Electron Microscopy with an annexed energy dispersive spectrometer (SEM/EDS), allowing for the morphological and chemical characterization of the observed particles/fibers. Moreover, this technique is envisaged by Italian Law for asbestos identification in air and bulk samples. On the other hand, this technique does not allow a reliable identification of the mineral phase in the case of polymorphs with the same chemical formula but different crystal structures. In this work, the coupling of a spectroscopical technique—micro-Raman spectroscopy—to SEM/EDS is proposed for a sure phase identification of particles, showing EDS spectra with ambiguous phase identification, observed in samples of tissues from patients affected by colorectal cancer and living in an asbestos-polluted area. In these tissues, different particles with EDS spectra that do not allow a sure identification of the phase—in particular calcium-rich particles and titanium oxides—were successively analyzed by micro-Raman spectroscopy. Thanks to this last technique, it was possible to ascribe the mineral phases associated to these particles to “aragonite” (a calcium carbonate polymorph) and to “anatase” (a Ti dioxide polymorph).
Bi/CeO2–Decorated CuS Electrocatalysts for CO2-to-Formate Conversion
Authors: Wang Qi , Bao Tianshuang , Zhao Xiangchuan , Cao Yue , Cao Jun , Li Qiaoling , Si Weimeng
Published: June 2024

The electrocatalytic carbon dioxide (CO2) reduction reaction (CO2RR) is extensively regarded as a promising strategy to reach carbon neutralization. Copper sulfide (CuS) has been widely studied for its ability to produce C1 products with high selectivity. However, challenges still remain owing to the poor selectivity of formate. Here, a Bi/CeO2/CuS composite was synthesized using a simple solvothermal method. Bi/CeO2–decorated CuS possessed high formate selectivity, with the Faraday efficiency and current density reaching 88% and 17 mA cm−2, respectively, in an H-cell. The Bi/CeO2/CuS structure significantly reduces the energy barrier formed by OCHO*, resulting in the high activity and selectivity of the CO2 conversion to formate. Ce4+ readily undergoes reduction to Ce3+, allowing the formation of a conductive network of Ce4+/Ce3+. This network facilitates electron transfer, stabilizes the Cu+ species, and enhances the adsorption and activation of CO2. Furthermore, sulfur catalyzes the OCHO* transformation to formate. This work describes a highly efficient catalyst for CO2 to formate, which will aid in catalyst design for CO2RR to target products.
Determination of Flavonolignan Compositional Ratios in Silybum marianum (Milk Thistle) Extracts Using High-Performance Liquid Chromatography
Authors: Chen Wei , Zhao Xi , Huang Zhenghua , Luo Shihui , Zhang Xuguang , Sun Wei , Lan Tao , He Ruikun
Published: June 2024

Milk thistle is one of the most popular ingredients in the liver protection products market. Silymarin is the main component of milk thistle and contains multiple isomers. There have been few studies focusing on the compositional ratios of silymarin isomers. In this study, we developed an HPLC method for the separation and quantification of silymarin isomers, thereby elucidating their compositional ratios. Through the analysis of more than 40 milk thistle extract products on the market, we found that the ratios, specifically Ratio 1 (the silybin B content to the silybin A content, SBNB/SBNA) and Ratio 2 (the sum of the contents of silybin B and isosilybin B to the sum of the contents of silybin A and isosilybin A, (SBNB + IBNB)/(SBNA + IBNA)), are highly consistent across milk thistle extracts, averaging approximately 1.58 and 1.28, respectively. Furthermore, such ratios were verified in milk thistle seed samples. This study introduces significant findings concerning the stable ratios among silymarin isomers in milk thistle extracts and seeds, thereby offering an innovative approach for quality assurance of milk thistle extracts.
The Temperature Dependence of Hydrogen Bonds Is More Uniform in Stable Proteins: An Analysis of NMR h3JNC′ Couplings in Four Different Protein Structures
Authors: Alexandrescu Andrei T. , Dregni Aurelio J.
Published: June 2024

Long-range HNCO NMR spectra for proteins show crosspeaks due to 1JNC′, 2JNC′, 3JNCγ, and h3JNC′ couplings. The h3JNC′ couplings are transmitted through hydrogen bonds and their sizes are correlated to hydrogen bond lengths. We collected long-range HNCO data at a series of temperatures for four protein structures. P22i and CUS-3i are six-stranded beta-barrel I-domains from phages P22 and CUS-3 that share less than 40% sequence identity. The cis and trans states of the C-terminal domain from pore-forming toxin hemolysin ΙΙ (HlyIIC) arise from the isomerization of a single G404-P405 peptide bond. For P22i and CUS-3i, hydrogen bonds detected by NMR agree with those observed in the corresponding domains from cryoEM structures of the two phages. Hydrogen bond lengths derived from the h3JNC′ couplings, however, are poorly conserved between the distantly related CUS-3i and P22i domains and show differences even between the closely related cis and trans state structures of HlyIIC. This is consistent with hydrogen bond lengths being determined by local differences in structure rather than the overall folding topology. With increasing temperature, hydrogen bonds typically show an apparent increase in length that has been attributed to protein thermal expansion. Some hydrogen bonds are invariant with temperature, however, while others show apparent decreases in length, suggesting they become stabilized with increasing temperature. Considering the data for the three proteins in this study and previously published data for ubiquitin and GB3, lowered protein folding stability and cooperativity corresponds with a larger range of temperature responses for hydrogen bonds. This suggests a partial uncoupling of hydrogen bond energetics from global unfolding cooperativity as protein stability decreases.
Fragmentation Patterns of Phenolic C-Glycosides in Mass Spectrometry Analysis
Authors: Du Ting , Wang Yang , Xie Huan , Liang Dong , Gao Song
Published: June 2024

Background: Many phenolic C-glycosides possess nutritional benefits and pharmacological efficacies. However, the MS/MS fragmentation pattern of phenolic C-glycosides analysis is understudied. This paper aims to determine the MS/MS fragmentation patterns of phenolic C-glycosides. Method: Ten compounds with different sugar moieties, aglycones, and substitutes were analyzed to determine the impact of these structural features on MS/MS fragmentation using UPLC-QTOF-MS analysis. Results: The results showed that water loss followed by RDA reaction and alpha cleavage in the C-C bonded sugar moieties are the major fragmentation pathways. Additionally, the sugar cleavage was not affected by the skeleton and the substitute of the aglycones. These results suggested that the fragmentation patterns of phenolic C-glycosides differ from those in the O-glycosides, where the O-C glycosidic bond is the most cleavage-liable bond in MS/MS analysis. Conclusions: These MS/MS fragmentation patterns can be used for the identification of C-glycosides from dietary components and herbal medicine as well as developing robust methods using MRM methods to quantify C-glycosides.
Effect of Storage Conditions on the Volatilome, Biochemical Composition and Quality of Golden Delicious and Red Delicious Apple (Malus domestica) Varieties
Authors: Ferreira Cláudio , Ribeiro Carlos , Nunes Fernando M.
Published: June 2024

The effects of normal (NA) and controlled atmosphere (CA) storage and postharvest treatment with 1-methylcyclopropene (1-MCP) before CA storage for 5 months on the volatilome, biochemical composition and quality of ‘Golden Delicious’ (GD) and ‘Red Delicious’ (RD) apples were studied. Apples stored under NA and CA maintained and 1-MCP treatment increased firmness in both cultivars. NA storage resulted in a decrease of glucose, sucrose and fructose levels in both cultivars. When compared to CA storage, 1-MCP treatment caused a more significant decrease in sucrose levels and an increase in glucose levels. Additionally, 1-MCP-treated apples exhibited a significant decrease in malic acid content for both cultivars. All storage conditions led to significant changes in the abundance and composition of the volatilome in both cultivars. GD and RD apples responded differently to 1-MCP treatment compared to CA storage; higher abundance of hexanoate esters and (E,E)-α-farnesene was observed in RD apples treated with 1-MCP. While 1-MCP was effective in reducing (E,E)-α-farnesene abundance in GD apples, its impact on RD apples was more limited. However, for both cultivars, all storage conditions resulted in lower levels of 2-methylbutyl acetate, butyl acetate and hexyl acetate. The effectiveness of 1-MCP is cultivar dependent, with GD showing better results than RD.
Asymmetric Mannich/Cyclization Reaction of 2-Benzothiazolimines and 2-Isothiocyano-1-indanones to Construct Chiral Spirocyclic Compounds
Authors: Zheng Yao , Du Da-Ming
Published: June 2024

An efficient and practical organocatalyzed asymmetric Mannich/cyclization tandem reaction strategy of 2-benzothiazolimines and 2-isothiocyanato-1-indanones was developed, and novel spirocyclic compounds containing benzothiazolimine and indanone scaffolds were obtained. This chiral thiourea-catalyzed Mannich/cyclization tandem reaction offers chiral spirocyclic compounds with continuous tertiary and quaternary stereocenters in good to high yields (up to 90%) with excellent diastereoselectivities (up to >20:1 dr) and enantioselectivities (up to 98% ee) at −18 °C. Additionally, the scaled-up synthesis was also performed with retained yield and stereoselectivity, and a reaction mechanism was also proposed.
The Acid Roles of PtSn@Al2O3 in the Synthesis and Performance of Propane Dehydrogenation
Authors: Niu Hejingying , Ma Jinhua , Gan Lina , Li Kezhi
Published: June 2024

In this study, a PtSn/Al2O3 catalyst with bimetallic uniform distribution in the sphere was synthesized. The PDH performance and characterization analyses, such as with FTIR, XPS, and NH3-TPD, were investigated. The effects of acid on the PDH performance were analyzed. Citric acid (CA) acted as a competing adsorbent in the preparation process of the PtSn/Al2O3 catalyst to synthesize the uniform catalyst. Water washing and alkali-treated samples were also studied. SEM line scanning revealed that increased the apparent concentration of Pt metal from 0.23 to 0.30 with citric acid. In contrast to the fresh PtSn/Al2O3 catalyst, the addition of citric acid increased the PDH selectivity from 74% to 93%. After alkali or water washing treatments, the catalyst’s selectivity further increased to 96%. Strong acid sites promoted the breaking of C–C bonds during the PDH reaction, resulting in more methane and ethylene byproducts, and decreased catalyst selectivity for fresh PtSn/Al2O3. From the PDH reaction thermodynamic analysis, a relatively sub-atmospheric pressure environment with a lower propane pressure could be the reasonable choice.
Precursor-Driven Catalytic Performances of Al2O3-Supported Earth-Abundant Ni Catalysts in the Hydrogenation of Levulinic Acid and Hydroxymethylfurfural into Added-Value Chemicals
Authors: Jędrzejczyk Marcin , Żyłka Emilia , Chałupka-Śpiewak Karolina , Ruppert Agnieszka M.
Published: June 2024

It has been shown that the nature of the metal precursor and the thermal effects during calcination determine the physicochemical properties of the catalysts and their catalytic activity in the levulinic acid (LA) and 5-hydroxymethylfurfural (HMF) hydrogenation reactions. The endothermic effect during calcination of the inorganic nickel precursor promoted higher metal dispersion and stronger interaction with the alumina surface. In contrast, the exothermic effects during the calcination of organic nickel precursors resulted in smaller metal dispersion and lower interaction with the support surface. A clear relationship was found between the size of the metal crystallites and the yield of LA hydrogenation reaction. The smaller crystallites were more active in the LA hydrogenation reaction. In turn, the size of the metal particles and their nature of interaction with the surface of the alumina influence the hydrogenation pathways of the HMF.
Study of the Preparation and Performance of TiO2-Based Magnetic Regenerative Adsorbent
Authors: Tian Dahui , Hao Jiarui , Guo Xiaojie
Published: June 2024

Against the backdrop of “carbon neutrality”, the green treatment of dye wastewater is particularly important. Currently, the adsorption method shows strong application prospects. Therefore, selecting efficient and recyclable adsorbents is of significant importance. TiO2 is an excellent adsorbent, but its difficult recovery often leads to secondary pollution. γ-Fe2O3-modified coal-series kaolin exhibits both excellent adsorption properties and rapid separation through magnetic separation technology. By utilizing the synergistic effects of both, TiO2/-γFe2O3 coal-series kaolin, magnetic adsorbent regeneration materials were prepared using coprecipitation method and characterized. The influencing factors of this functional material on the adsorption of Congo red dye and its regeneration performance are discussed. The experimental results indicated that the specific surface area, pore volume and Ms value of this functional material are 127.5 m2/g, 0.38 cm3/g, and 13.4 emu/g, respectively. It exhibits excellent adsorption characteristics towards Congo red, with an adsorption rate reaching 96.8% within 10 min, conforming to the pseudo-second-order kinetic model, and demonstrating Langmuir IV-type monolayer adsorption. After the adsorption of Congo red, magnetic separation shows superior efficiency. Furthermore, treatment of the adsorbed composite with EDTA allows for recycling, with adsorption rates still above 91% after three cycles, indicating an excellent regeneration capability.
Colistin: Lights and Shadows of an Older Antibiotic
Authors: Diani Erica , Bianco Gabriele , Gatti Milo , Gibellini Davide , Gaibani Paolo
Published: June 2024

The emergence of antimicrobial resistance represents a serious threat to public health and for infections due to multidrug-resistant (MDR) microorganisms, representing one of the most important causes of death worldwide. The renewal of old antimicrobials, such as colistin, has been proposed as a valuable therapeutic alternative to the emergence of the MDR microorganisms. Although colistin is well known to present several adverse toxic effects, its usage in clinical practice has been reconsidered due to its broad spectrum of activity against Gram-negative (GN) bacteria and its important role of “last resort” agent against MDR-GN. Despite the revolutionary perspective of treatment with this old antimicrobial molecule, many questions remain open regarding the emergence of novel phenotypic traits of resistance and the optimal usage of the colistin in clinical practice. In last years, several forward steps have been made in the understanding of the resistance determinants, clinical usage, and pharmacological dosage of this molecule; however, different points regarding the role of colistin in clinical practice and the optimal pharmacokinetic/pharmacodynamic targets are not yet well defined. In this review, we summarize the mode of action, the emerging resistance determinants, and its optimal administration in the treatment of infections that are difficult to treat due to MDR Gram-negative bacteria.
Enhanced Cadmium Adsorption Dynamics in Water and Soil by Polystyrene Microplastics and Biochar
Authors: Wang Mengmeng , Jiang Xuyou , Wei Zhangdong , Wang Lin , Song Jiashu , Cen Peitong
Published: June 2024

Microplastics (MPs) are prevalent emerging pollutants in soil environments, acting as carriers for other contaminants and facilitating combined pollution along with toxic metals like cadmium (Cd). This interaction increases toxic effects and poses substantial threats to ecosystems and human health. The objective of this study was to investigate the hydrodynamic adsorption of Cd by conducting experiments where polystyrene microplastics (PS) and biochar (BC) coexisted across various particle sizes (10 µm, 20 µm, and 30 µm). Then, soil incubation experiments were set up under conditions of combined pollution, involving various concentrations (0.5 g·kg−1, 5 g·kg−1, 50 g·kg−1) and particle sizes of PS and BC to assess their synergistic effects on the soil environment. The results suggest that the pseudo-second-order kinetic model (R2 = 0.8642) provides a better description of the adsorption dynamics of Cd by PS and BC compared to the pseudo-first-order kinetic model (R2 = 0.7711), with an adsorption saturation time of 400 min. The Cd adsorption process in the presence of PS and BC is more accurately modeled using the Freundlich isotherm (R2 > 0.98), indicating the predominance of multilayer physical adsorption. The coexistence of 10 µm and 20 µm PS particles with BC enhanced Cd absorption, while 30 µm PS particles had an inhibitory effect. In soil incubation experiments, variations in PS particle size increased the exchangeable Cd speciation by 99.52% and decreased the residual speciation by 18.59%. The addition of microplastics notably impacted the exchangeable Cd speciation (p < 0.05), with smaller PS particles leading to more significant increases in the exchangeable content—showing respective increments of 45.90%, 106.96%, and 145.69%. This study contributes to a deeper understanding of the mitigation mechanisms of biochar in the face of combined pollution from microplastics and heavy metals, offering theoretical support and valuable insights for managing such contamination scenarios.
Influence of Water on Aging Phenomena of Calendric Stored and Cycled Li-Ion Batteries
Authors: Wilhelm Gudrun , Golla-Schindler Ute , Wöhrl Katharina , Geisbauer Christian , Cooke Graham , Bernthaler Timo , Schweiger Hans-Georg , Schneider Gerhard
Published: June 2024

We examine the impact of water (160 ± 41 ppm of reference) on the anode, cathode, separator and electrolyte in two aging scenarios: calendric aging (60 °C, 80 days, charged state), resulting in a triggered current interrupt device (CID), and cycling 1680 times (charge/discharge with 1C, 2.75–4.2 V, 20 ± 2 °C), resulting in 24.5% residual capacity. We applied computer tomography (CT), scanning electron microscopy (SEM), energy dispersive spectroscopy (EDS) and secondary ion mass spectrometry (SIMS) to understand the capacity loss. The aged NMC/LCO–graphite cells were compared to a reference cell in pristine state. Both aging scenarios showed (a) thick depositions on the anode and cathode consisting mainly of oxygen, fluorine and phosphorous, (b) reduced separator pore sizes, (c) the deposition of Mn, Co and Ni on top of the anode and (d) the decomposition of the conductive salt LiPF6 accompanied by HF formation and a loss of active lithium. Calendric aging consumes the water content and additionally leads to (e) the decomposition of the organic solvent followed by CO2 gas formation. Cyclic aging increases the water content and additionally results in (f) the consumption of the additive fluoroethylene carbonate (FEC). These findings show how water affects aging phenomena and results in a capacity decrease in the cell.
Anesthesia for Endovascular Therapy for Stroke
Authors: Gaspari Arianna , Vaccari Giulia , Arturi Federica , Melegari Gabriele , Baroni Stefano
Published: June 2024

Background: In patients with acute ischemic stroke, the standard of care is to perform intra-arterial endovascular thrombectomy in addition to intravenous thrombolysis. In this study, we investigated the different anesthetic techniques chosen for this procedure and clinical outcomes. Methods: Patients undergoing endovascular procedures were divided into three groups. The first group consisted of patients who received general anesthesia, the second group underwent the procedure under conscious sedation and local anesthesia at the catheter insertion site, and lastly the third group included patients who received only local anesthesia at the catheter insertion site, without sedation. Results: During the endovascular procedure, we did not notice significant differences in vital parameters, in particular the mean blood pressure (MAP) between patients treated with different types of anesthesia. Also, the duration of the revascularization did not show significant differences between the three groups. The main point is the absence of differences in terms of functional and clinical outcomes, using various scores as reference, such as the National Institutes of Health Stroke Scale (NIHSS) score at 7 days, NIHSS and Modified Rankin Scale (MRS) at time of discharge, and MRS after 3 months. These scores did not show significant differences in groups treated with different types of anesthesia. Conclusions: The rate of success of the revascularization procedure is almost overlapping between patients treated with conscious sedation and general anesthesia. In addition, we did not notice significant differences between groups in terms of functional and clinical outcomes. Considering the possible usefulness of applying conscious sedation, at OCSAE of Baggiovara, an internal protocol for conscious sedation was introduced to standardize the treatment in patients undergoing endovascular procedures.