bluuebunny/crossref_metadata_2025 huggingface dataset:
In Vitro Susceptibility to Ceftazidime-Avibactam and Comparator Antimicrobial Agents of Carbapenem-Resistant Enterobacterales Isolates
Authors: Lim Tze-Peng , Ho Jun-Yuan , Teo Jocelyn Qi-Min , Sim James Heng-Chiak , Tan Si-Hui , Tan Thuan-Tong , Kwa Andrea Lay-Hoon
Published: August 2023

The emergence of carbapenem-resistant Enterobacterales (CRE) has been recognized as a significant concern globally. Ceftazidime/avibactam (CZA) is a novel β-lactam/β-lactamase inhibitor that has demonstrated activity against isolates producing class A, C, and D β-lactamases. Here-in, we evaluated the in vitro activity of CZA and comparator antimicrobial agents against 858 CRE isolates, arising from the Southeast Asian region, collected from a large tertiary hospital in Singapore. These CRE isolates mainly comprised Klebsiella pneumoniae (50.5%), Escherichia coli (29.4%), and Enterobacter cloacae complex (17.1%). Susceptibility rates to levofloxacin, imipenem, meropenem, doripenem, aztreonam, piperacillin/tazobactam, cefepime, tigecycline, and polymyxin B were low. CZA was the most active β-lactam agent against 68.9% of the studied isolates, while amikacin was the most active agent among all comparator antibiotics (80% susceptibility). More than half of the studied isolates (51.4%) identified were Klebsiella pneumoniae carbapenemase (KPC)-2 producers, 25.9% were New Delhi metallo-β-lactamase (NDM) producers, and Oxacillinase (OXA)-48-like producers made up 10.7%. CZA was the most active β-lactam agent against KPC-2, OXA-48-like, and Imipenemase (IMI) producers (99.3% susceptible; MIC50/90: ≤1/2 mg/L). CZA had excellent activity against the non-carbapenemase-producing CRE (91.4% susceptible; MIC50/90: ≤1/8 mg/L). Expectedly, CZA had no activity against the metallo-β-lactamases (MBL)-producing CRE (NDM- and Imipenemase MBL (IMP) producers; 27.2% isolates), and the carbapenemase co-producing CRE (NDM + KPC, NDM + OXA-48-like, NDM + IMP; 3.0% isolates). CZA is a promising addition to our limited armamentarium against CRE infections, given the reasonably high susceptibility rates against these CRE isolates. Careful stewardship and rational dosing regimens are required to preserve CZA’s utility against CRE infections.
The Possible Role of Probiotic Supplementation in Inflammation: A Narrative Review
Authors: Colletti Alessandro , Pellizzato Marzia , Cicero Arrigo Francesco
Published: August 2023

The fine balance between symbiotic and potentially opportunistic and/or pathogenic microorganisms can undergo quantitative alterations, which, when associated with low intestinal biodiversity, could be responsible for the development of gut inflammation and the so-called “intestinal dysbiosis”. This condition is characterized by the disbalance of a fine synergistic mechanism involving the mucosal barrier, the intestinal neuroendocrine system, and the immune system that results in an acute inflammatory response induced by different causes, including viral or bacterial infections of the digestive tract. More frequently, however, dysbiosis is induced slowly and subtly by subliminal causal factors, resulting in a chronic condition related to different diseases affecting the digestive tract and other organs and apparatuses. Studies on animal models, together with studies on humans, highlight the significant role of the gut microbiota and microbiome in the occurrence of inflammatory conditions such as metabolic syndrome and cardiovascular diseases (CVDs); neurodegenerative, urologic, skin, liver, and kidney pathologies; and premature aging. The blood translocation of bacterial fragments has been found to be one of the processes linked to gut dysbiosis and responsible for the possible occurrence of “metabolic endotoxemia” and systemic inflammation, associated with an increased risk of oxidative stress and related diseases. In this context, supplementation with different probiotic strains has been shown to restore gut eubiosis, especially if administered in long-term treatments. The aim of this review is to describe the anti-inflammatory effects of specific probiotic strains observed in clinical trials and the respective indications, highlighting the differences in efficacy depending on strain, formulation, time and duration of treatment, and dosage used.
Listeria Occurrence in Conventional and Alternative Egg Production Systems
Authors: Ricke Steven C. , O’Bryan Corliss A. , Rothrock Michael J.
Published: August 2023

Listeria continues to be a persistent foodborne pathogen that is responsible for human cases of listeriosis when contaminated food products are consumed. Human subjects considered to be most susceptible include the elderly, immunocompromised, and pregnant women. Listeria is characterized as a saprophytic organism with the capability of responding and adapting to constantly changing environments because it possesses multiple stress response mechanisms to overcome varying temperatures, salt concentrations, and pH, among others. Primary foods and food products associated with listeriosis include dairy products and ready-to-eat meats such as turkey products. Historically, chicken eggs have not been identified as a primary source of Listeria, but the potential for contamination during egg production and processing does exist. Listeria species have been isolated from egg-processing plant equipment and are presumed to occur in egg-processing plant environments. Whether Listeria is consistently disseminated onto eggs beyond the egg-processing plant is a risk factor that remains to be determined. However, research has been conducted over the years to develop egg wash solutions that generate combinations of pH and other properties that would be considered inhibitory to Listeria. Even less is known regarding the association of Listeria with alternative egg production systems, but Listeria has been isolated from pasture flock broilers, so it is conceivable, given the nature of the outdoor environments, that layer birds under these conditions would also be exposed to Listeria and their eggs become contaminated. This review focuses on the possibility of Listeria occurring in conventional and alternative egg-laying production and processing systems.
Clinical Sepsis Phenotypes in Critically Ill Patients
Authors: Papathanakos Georgios , Andrianopoulos Ioannis , Xenikakis Menelaos , Papathanasiou Athanasios , Koulenti Despoina , Blot Stijn , Koulouras Vasilios
Published: August 2023

Sepsis, defined as the life-threatening dysregulated host response to an infection leading to organ dysfunction, is considered as one of the leading causes of mortality worldwide, especially in intensive care units (ICU). Moreover, sepsis remains an enigmatic clinical syndrome, with complex pathophysiology incompletely understood and a great heterogeneity both in terms of clinical expression, patient response to currently available therapeutic interventions and outcomes. This heterogeneity proves to be a major obstacle in our quest to deliver improved treatment in septic critical care patients; thus, identification of clinical phenotypes is absolutely necessary. Although this might be seen as an extremely difficult task, nowadays, artificial intelligence and machine learning techniques can be recruited to quantify similarities between individuals within sepsis population and differentiate them into distinct phenotypes regarding not only temperature, hemodynamics or type of organ dysfunction, but also fluid status/responsiveness, trajectories in ICU and outcome. Hopefully, we will eventually manage to determine both the subgroup of septic patients that will benefit from a therapeutic intervention and the correct timing of applying the intervention during the disease process.
Prevalence and Genetic Diversity of Cross-Assembly Phages in Wastewater Treatment Plants in Riyadh, Saudi Arabia
Authors: Alotaibi Riyadh , Eifan Saleh , Hanif Atif , Nour Islam , Alkathiri Abdulrahman
Published: August 2023

The most common DNA virus found in wastewaters globally is the cross-assembly phage (crAssphage). King Saud University wastewater treatment plant (KSU-WWTP); Manfoha wastewater treatment plant (MN-WWTP); and the Embassy wastewater treatment plant (EMB-WWTP) in Riyadh, Saudi Arabia were selected, and 36 untreated sewage water samples during the year 2022 were used in the current study. The meteorological impact on crAssphage prevalence was investigated. CrAssphage prevalence was recorded using PCR and Sanger sequencing. The molecular diversity of crAssphage sequences was studied for viral gene segments from the major capsid protein (MCP) and membrane protein containing the peptidoglycan-binding domain (MP-PBD). KSU-WWTP and EMB-WWTP showed a higher prevalence of crAssphage (83.3%) than MN-WWTP (75%). Phylogenetic analysis of MCP and MP-PBD segments depicted a close relationship to the Japanese isolates. The MCP gene from the current study’s isolate WW/2M/SA/2022 depicted zero evolutionary divergence from 3057_98020, 2683_104905, and 4238_99953 isolates (d = 0.000) from Japan. A significant influence of temporal variations on the prevalence of crAssphage was detected in the three WWTPs. CrAssphage displayed the highest prevalence at high temperatures (33–44 °C), low relative humidity (6–14%), and moderate wind speed (16–21 Km/h). The findings provided pioneering insights into crAssphage prevalence and its genetic diversity in WWTPs in Riyadh, Saudi Arabia.
Cyclospora cayetanensis: A Perspective (2020–2023) with Emphasis on Epidemiology and Detection Methods
Authors: Almeria Sonia , Chacin-Bonilla Leonor , Maloney Jenny G. , Santin Monica
Published: August 2023

Cyclospora cayetanensis infections are prevalent worldwide, and the parasite has become a major public health and food safety concern. Although important efforts have been dedicated to advance toward preventing and reducing incidences of cyclosporiasis, there are still several knowledge gaps that hamper the implementation of effective measures to prevent the contamination of produce and water with Cyclospora oocysts. Some of these data gaps can be attributed to the fact that access to oocysts is a limiting factor in C. cayetanensis research. There are no animal models or in vivo or in vitro culture systems to propagate the oocysts needed to facilitate C. cayetanensis research. Thus, researchers must rely upon limited supplies of oocysts obtained from naturally infected human patients considerably restricting what can be learnt about this parasite. Despite the limited supply of C. cayetanensis oocysts, several important advances have happened in the past 3 years. Great progress has been made in the Cyclospora field in the areas of molecular characterization of strains and species, generation of genomes, and development of novel detection methods. This comprehensive perspective summarizes research published from 2020 to 2023 and evaluates what we have learnt and identifies those aspects in which further research is needed.
Global Risk Maps of Climate Change Impacts on the Distribution of Acinetobacter baumannii Using GIS
Authors: Sabour Amal
Published: August 2023

Impacts of climate change rank among the century’s most significant ecological and medical concerns. As a result of climatic changes, the distribution of some bacterial species will alter across time and space. Numerous bacterial infections will reorganize as a result worldwide. Acinetobacter baumannii Bouvet and Grimont is one of the most significant and frequently occurring bacteria identified in soil and air. The COVID-19 pandemic has changed how bacteriologists perceive this species as a new threat to human health. In order to estimate the existing and future worldwide distribution of A. baumannii under various climate change scenarios, about 1000 A. baumannii occurrence records were employed. Given its superior accuracy and dependability versus alternative modeling techniques, maximum entropy implemented in MaxEnt was selected as the modeling tool. The bioclimatic variable that contributes the most to the distribution of A. baumannii is the mean temperature of the coldest quarter (bio_11). The created current distribution model agreed with the species’ actual globally dispersed distribution. It is projected that A. baumannii will experience a severe range expansion due to the increase in temperature brought on by global warming in different regions of its range. According to the risk maps created for 2050 and 2070 using two alternative RCPs, there are various regions that will be under risk of this bacterium as a result of rising temperature. Future data science and GIS evaluation of the current results are necessary, especially on a local level.
Advances in Analysis of the Fe-Ni-Co Alloy and Iron-Bearing Minerals in Meteorites by Mössbauer Spectroscopy with a High Velocity Resolution
Authors: Goryunov Michael V. , Maksimova Alevtina A. , Oshtrakh Michael I.
Published: August 2023

Meteorites are the space messengers bringing us the unique information about the Solar System formation and evolution as well as about the effects of various extreme space conditions on meteorites and their parent bodies. The main iron-bearing compounds in meteorites are Fe-Ni-Co alloy, olivine (Fe, Mg)2SiO4, orthopyroxene (Fe, Mg)SiO3, clinopyroxene (Ca, Fe, Mg)SiO3, troilite FeS, chromite FeCr2O4, hercynite FeAl2O4, ilmenite FeTiO3, daubréelite FeCr2S4, schreibersite (Fe, Ni)3P and some other compounds. Therefore, 57Fe Mössbauer spectroscopy was successfully applied for the analyses of various meteorites for about 60 years of experience. The development of Mössbauer spectrometers with a high velocity resolution, i.e., with a high discretization of the velocity reference signal up to 212, provides much better adjustment to resonance and significantly increases the spectra quality and analytical possibilities of Mössbauer spectroscopy. In fact, this permits us to decompose the complex Mössbauer spectra of meteorites using the larger number of spectral components related to reliable compounds in comparison with the results obtained using conventional Mössbauer spectrometers with discretization of the velocity reference signal up to 29. In the present review we consider the results and advances of various meteorites analyses by means of Mössbauer spectroscopy with a high velocity resolution.
Petrogenesis of Devonian and Permian Pegmatites in the Chinese Altay: Insights into the Closure of the Irtysh–Zaisan Ocean
Authors: Wang Mengtao , Zhang Xin
Published: August 2023

Owing to tectonic, magmatic, and metamorphic controls, pegmatites associated with different spatiotemporal distributions exhibit varying mineralisation characteristics. The petrogenesis of pegmatites containing rare metals can improve the understanding of geodynamic processes in the deep subsurface. In order to understand the difference of petrogenesis between Devonian and Permian pegmatites, zircon U-Pb geochronological and Hf-O isotope analyses were performed on samples of the Jiamanhaba, Amulagong, and Tiemulete pegmatites from the Chinese Altay. According to the results obtained, the Amulagong and Tiemulete pegmatites were formed during the Devonian, and samples that were analysed yielded zircon U-Pb ages of 373.0 ± 7.8 and 360 ± 5.2 Ma, respectively. Samples from these pegmatites produced εHf(t) values of 2.87–7.39, two-stage model ages of 900–1171 Ma and δ18O values of 9.55‰–15.86‰. These results suggest that the pegmatites were formed via an anatexis of mature sedimentary rocks deep in the crust. In contrast, the Jiamanhaba pegmatite was formed during the Permian, and its samples produced εHf(t) and δ18O values of 2.87–4.94 and 6.05‰–7.32‰, respectively, which indicate that the associated magma contained minor amounts of mantle/juvenile materials. The petrogenesis of pegmatites containing rare metals can reveal tectonic settings of their formation. A combination of data that were generated in the present study and existing geochronological and Hf-O isotope data for felsic igneous and sedimentary rocks in the Chinese Altay shows that the εHf(t) sharply increased while the δ18O suddenly decreased between Late Carboniferous and Early Permian. These changes highlight a tectonic transformation event during this critical period. This tectonic event promoted mantle–crustal interactions, and thus, it was probably linked to assemblages of the Altay orogen and the Junggar Block. The present study provides evidence that the Irtysh–Zaisan Ocean probably closed during the Late Carboniferous (~300 Ma).
Mineral Carbonation Potential (MCP) of Mine Waste Material: Derivation of an MCP Parameter
Authors: Jacobs Anthony , Hitch Michael , Mosallanejad Sara , Bhatelia Tejas , Li Jiajie , Farhang Faezeh
Published: August 2023

The heterogenous mineralogy of ultramafic deposits hosting mining operations makes it challenging to accurately determine the waste rock’s mineral carbonation potential (MCP). Additionally, the significantly higher carbonation capabilities of olivine than serpentine add to the difficulty. To address this issue, in this work, a new and unique tool called the MCP calculator was developed as a Microsoft ExcelTM spreadsheet to accurately determine the amount of anthropogenic CO2 that a given rock mass can sequester through mineral carbonation. The program estimates the modal mineral abundance of ultramafic rocks to aid in MCP estimation. This tool is designed to be cost-effective and tailored for use by the mining industry, utilising abundant lithogeochemical data to evaluate their deposit as a potential substrate for industrial mineral carbonation operations. The paper introduces the MCP calculator, outlines a framework for developing the MCP parameter, and presents an example of its application. The calculator is specific to the mineral assemblage investigated at the Turnagain ultramafic complex in northern British Columbia but can be adjusted to study comparable deposits. The paper acknowledges that using waste rock in a mineral carbonation operation requires economic and practical decisions beyond the scope of the research.
Insight on the Properties of Pumice Mineral for the Combined Adsorption Distillation of Membrane Reject Water
Authors: Qureshi Tayyab A. , Gadhi Tanveer A. , Khokhar Danish A. , Ali Imran , Memon Najma , Channa Najeebullah , Bakhat Sikandar , Rafique Tahir , Mahar Rasool Bux
Published: August 2023

The current study evaluated the use of pumice, a volcanic mineral and common sand, in treating reverse osmosis membrane reject water (ROR) using a novel combined adsorption distillation (CAD) method. The CAD method is developed to separate the dissolved solids through adsorption distillation, i.e., leaving the vaporized distillate as freshwater and concentrated brine. The adsorption potential of pumice and sand was investigated at different adsorbent doses, i.e., 2, 5, and 10 g, and consecutive CAD adsorbent backwashing cycles. The improved results were achieved at a 10 g pumice dose. However, its adsorption efficiency declined in longer CAD cycles, i.e., due to the separated deposition of solids. After backwashing, the adsorbed and accumulated salts were slightly removed, and pumice adsorption capacity was maintained for up to 20 cycles of CAD. The properties of the pumice, i.e., before and after five CAD cycles and after backwashing, were characterized with scanning electron microscopic (SEM), elemental disruptive spectroscopy (EDS), and X-ray diffraction (XRD), which revealed that the porous structure of the pumice was completely accumulated with deposits of ionic salts, which were slightly washed away after backwashing, but accumulation remained continued in post-CAD cycles. The explored method revealed a high potential of pumice in water filtration.
Geochemical Modeling of Copper Mineralization Using Geostatistical and Machine Learning Algorithms in the Sahlabad Area, Iran
Authors: Shirazi Aref , Hezarkhani Ardeshir , Shirazy Adel , Pour Amin
Published: August 2023

Analyzing geochemical data from stream sediment samples is one of the most proactive tools in the geochemical modeling of ore mineralization and mineral exploration. The main purpose of this study is to develop a geochemical model for prospecting copper mineralization anomalies in the Sahlabad area, South Khorasan province, East Iran. In this investigation, 709 stream sediment samples were analyzed using inductively coupled plasma mass spectrometry (ICP-MS), and geostatistical and machine learning techniques. Subsequently, hierarchical analysis (HA), Spearman’s rank correlation coefficient, concentration–area (C–A) fractal analysis, Kriging interpolation, and descriptive statistics studies were performed on the geochemical dataset. Machine learning algorithms, namely K-means clustering, factor analysis (FA), and linear discriminant analysis (LDA) were employed to deliver a comprehensive geochemical model of copper mineralization in the study area. The identification of trace elements and the predictor composition of copper mineralization, the separation of copper geochemical communities, and the investigation of the geochemical behavior of copper vs. its trace elements were targeted and accomplished. As a result, the elements Ag, Mo, Pb, Zn, and Sn were distinguished as trace elements and predictors of copper geochemical modeling in the study area. Additionally, geochemical anomalies of copper mineralization were identified based on trace elements. Conclusively, the nonlinear behavior of the copper element versus its trace elements was modeled. This study demonstrates that the integration and synchronous use of geostatistical and machine learning methods can specifically deliver a comprehensive geochemical modeling of ore mineralization for prospecting mineral anomalies in metallogenic provinces around the globe.
Graphene Oxide Enhanced Cisplatin Cytotoxic Effect in Glioblastoma and Cervical Cancer
Authors: Kregielewski Kacper , Fraczek Wiktoria , Grodzik Marta
Published: August 2023

Graphene oxide (GO) is an oxidized derivative of graphene. So far, GO has mostly been studied as a drug delivery method rather than a standalone drug for treating cancers like glioblastoma or cervical cancer. However, we propose a promising new approach—using GO as a sensitizer for cisplatin chemotherapy. Here, we analyze the effects of triple GO pretreatment, followed by cisplatin treatment, on cancerous cell lines U87 and HeLa, as well as the noncancerous cell line HS-5, through morphology analysis, viability assay, flow cytometry, and LDH release assay. The viability assay results showed that GO treatment made U87 and HeLa cells more responsive to cisplatin, leading to a significant reduction in cell viability to 40% and 72%, respectively, without affecting HS-5 cells viability, while the Annexin V/Propidium iodine assay showed that GO pretreatment did not cause a change in live cells in all three examined cell lines, while GO-pretreated HeLa cells treated with cisplatin showed significant decrease around two times compared to cells treated with cisplatin standalone. The U87 cell line showed a significant increase in LDH release, approximately 2.5 times higher than non-GO-pretreated cells. However, GO pretreatment did not result in LDH release in noncancerous HS-5 cells. It appears that this phenomenon underlays GO’s ability to puncture the cell membrane of cancerous cells depending on its surface properties without harming noncancerous cells.
Deacetylated Sialic Acid Sensitizes Lung and Colon Cancers to Novel Cucurbitacin-Inspired Estrone Epidermal Growth Factor Receptor (EGFR) Inhibitor Analogs
Authors: Anim Mathias T. , Tuffour Isaac , Willis Rylan , Schell Matthew , Ostlund Trevor , Mahnashi Mater H. , Halaweish Fathi , Willand-Charnley Rachel
Published: August 2023

Cancers utilize sugar residues such as sialic acids (Sia) to improve their ability to survive. Sia presents a variety of functional group alterations, including O-acetylation on the C6 hydroxylated tail. Previously, sialylation has been reported to suppress EGFR activation and increase cancer cell sensitivity to Tyrosine Kinase Inhibitors (TKIs). In this study, we report on the effect of deacetylated Sia on the activity of three novel EGFR-targeting Cucurbitacin-inspired estrone analogs (CIEAs), MMA 294, MMA 321, and MMA 320, in lung and colon cancer cells. Acetylation was modulated by the removal of Sialate O-Acetyltransferase, also known as CAS1 Domain-containing protein (CASD1) gene via CRISPR-Cas9 gene editing. Using a variety of cell-based approaches including MTT cell viability assay, flow cytometry, immunofluorescence assay and in-cell ELISA we observed that deacetylated Sia-expressing knockout cells (1.24–6.49 μM) were highly sensitive to all CIEAs compared with the control cells (8.82–20.97 μM). Apoptosis and varied stage cell cycle arrest (G0/G1 and G2/M) were elucidated as mechanistic modes of action of the CIEAs. Further studies implicated overexpression of CIEAs’ cognate protein target, phosphorylated EGFR, in the chemosensitivity of the deacetylated Sia-expressing knockout cells. This observation correlated with significantly decreased levels of key downstream proteins (phosphorylated ERK and mTOR) of the EGFR pathway in knockout cells compared with controls when treated with CIEAs. Collectively, our findings indicate that Sia deacetylation renders lung and colon cancer cells susceptible to EGFR therapeutics and provide insights for future therapeutic interventions.
H(N3)dap (Hdap = 2,6-Diaminopurine) Recognition by Cu2(EGTA): Structure, Physical Properties, and Density Functional Theory Calculations of [Cu4(μ-EGTA)2(μ-H(N3)dap)2(H2O)2]·7H2O
Authors: Mousavi Homa , García-Rubiño María Eugenia , Choquesillo-Lazarte Duane , Castiñeiras Alfonso , Lezama Luis , Frontera Antonio , Niclós-Gutiérrez Juan
Published: August 2023

Reactions in water between the Cu2(µ-EGTA) chelate (EGTA = ethylene-bis(oxyethyleneimino)tetraacetate(4-) ion) and Hdap in molar ratios 1:1 and 1:2 yield only blue crystals of the ternary compound [Cu4(μ-EGTA)2(μ-H(N3)dap)2(H2O)2]·7H2O (1), which has been studied via single-crystal X-ray diffraction and various physical methods (thermal stability, spectral and magnetic properties), as well as DFT theoretical calculations. In the crystal, uncoordinated water is disordered. The tetranuclear complex molecule also has some irrelevant disorder in an EGTA-ethylene moiety. In the complex molecule, both bridging organic molecules act as binucleating ligands. There are two distorted five- and two six-coordinated Cu(II) centers. Each half of EGTA acts as a tripodal tetradentate Cu(II) chelator, with a mer-NO2 + O(ether, distal) conformation. Hdap exhibits the tautomer H(N3)dap, with the dissociable H-atom on its less basic N-heterocyclic atom. These features favor the efficient cooperation between Cu-N7 or Cu-N9 bonds with appropriate O-EGTA atoms, as N6-H···O or N3-H···O interligand interactions, respectively. The bridging role of both organics determines the tetranuclear dimensionality of the complex. In this crystal, such molecules associate in zig-zag chains built by alternating π–π interactions between the five- or six-atom rings of Hdap ligands of adjacent molecules. DFT theoretical calculations (using two different theoretical models and characterized by the quantum theory of “atoms in molecules”) reveal the importance of these π–π interactions between Hdap ligands, as well as those corresponding to the referred hydrogen bonds in the contributed tetranuclear molecule.
Fabrication of AIE Polymer-Functionalized Reduced Graphene Oxide for Information Storage
Authors: Gao Kai , Li Wei , Wang Xiaoyang , Sun Sai , Zhang Bin
Published: August 2023

Reduced graphene oxide (RGO) has been extensively studied and applied in optoelectronic systems, but its unstable dispersion in organic solvents has limited its application. To overcome this problem, the newly designed and developed aggregation-induced emission (AIE) material poly[(9,9-bis(6-azidohexyl)-9H-fluorene)-alt-(9-(4-(1,2,2-triphenylvinyl)phenyl)-9H-carbazole)] (PAFTC) was covalently grafted onto RGO to produce (PFTC-g-RGO). The solubility of two-dimensional graphene was improved by incorporating it into the backbone of PAFTC to form new functional materials. In resistive random access memory (RRAM) devices, PFTC-g-RGO was used as the active layer material after it was characterized. The fabricated Al/PFTC-g-RGO/ITO device exhibited nonvolatile bistable resistive switching performances with a long retention time of over 104 s, excellent endurance of over 200 switching cycles, and an impressively low turn-ON voltage. This study provides important insights into the future development of AIE polymer-functionalized nanomaterials for information storage.
Heterometallic ZnHoMOF as a Dual-Responsive Luminescence Sensor for Efficient Detection of Hippuric Acid Biomarker and Nitrofuran Antibiotics
Authors: Yin Jingrui , Li Wenqian , Li Wencui , Liu Liying , Zhao Dongsheng , Liu Xin , Hu Tuoping , Fan Liming
Published: August 2023

Developing efficient and sensitive MOF-based luminescence sensors for bioactive molecule detection is of great significance and remains a challenge. Benefiting from favorable chemical and thermal stability, as well as excellent luminescence performance, a porous Zn(II)Ho(III) heterometallic–organic framework (ZnHoMOF) was selected here as a bifunctional luminescence sensor for the early diagnosis of a toluene exposure biomarker of hippuric acid (HA) through “turn-on” luminescence enhancing response and the daily monitoring of NFT/NFZ antibiotics through “turn-off” quenching effects in aqueous media with high sensitivity, acceptable selectivity, good anti-interference, exceptional recyclability performance, and low detection limits (LODs) of 0.7 ppm for HA, 0.04 ppm for NFT, and 0.05 ppm for NFZ. Moreover, the developed sensor was employed to quantify HA in diluted urine samples and NFT/NFZ in natural river water with satisfactory results. In addition, the sensing mechanisms of ZnHoMOF as a dual-response chemosensor in efficient detection of HA and NFT/NFZ antibiotics were conducted from the view of photo-induced electron transfer (PET), as well as inner filter effects (IFEs), with the help of time-dependent density functional theory (TD-DFT) and spectral overlap experiments.
The Impact of AAPH-Induced Oxidation on the Functional and Structural Properties, and Proteomics of Arachin
Authors: Shen Mingjuan , Yang Xi , Wang Zhenxing , Sha Xiaomei , Zhang Xuechun , Sun Jian
Published: August 2023

The aim of this study was to investigate the effect of 2,2′-azobis (2-amidinopropane) dihydrochloride (AAPH)-induced oxidation on the functional, structural properties and proteomic information of arachin. The results showed that moderate oxidation improved the water/oil holding capacity of proteins and increased the emulsifying stability, while excessive oxidation increased the carbonyl content, reduced the thiol content, altered the structure and thermal stability, and reduced most of the physicochemical properties. Through LC-QE-MS analysis, it was observed that oxidation leads to various modifications in arachin, including carbamylation, oxidation, and reduction, among others. In addition, 15 differentially expressed proteins were identified. Through gene ontology (GO) analysis, these proteins primarily affected the cellular and metabolic processes in the biological process category. Further Kyoto encyclopedia of genes and genomes (KEGG) analysis revealed that the “proteasome; protein processing in the endoplasmic reticulum (PPER)” pathway was the most significantly enriched signaling pathway during the oxidation process of arachin. In conclusion, this study demonstrated that AAPH-induced oxidation can alter the conformation and proteome of arachin, thereby affecting its corresponding functional properties. The findings of this study can potentially serve as a theoretical basis and foundational reference for the management of peanut processing and storage.
Design, Synthesis and Antifungal Activities of Novel Pyrazole Analogues Containing the Aryl Trifluoromethoxy Group
Authors: Zhao Tongchao , Sun Yuyao , Meng Yufei , Liu Lifang , Dai Jingwen , Yan Guoan , Pan Xiaohong , Guan Xiong , Song Liyan , Lin Ran
Published: August 2023

On the basis of the three-component synthetic methodology developed by us, a total of twenty-six pyrazole compounds bearing aryl OCF3 were designed and synthesized. Their chemical structures were characterized by 1H and 13C nuclear magnetic resonance and high-resolution mass spectrometry. These compounds were evaluated systematically for antifungal activities in vitro against six plant pathogenic fungi by the mycelium growth rate method. Most of the compounds showed some activity against each of the fungi at 100 μg/mL. Compounds 1t and 1v exhibited higher activity against all the tested fungi, and 1v displayed the highest activity against F. graminearum with an EC50 value of 0.0530 μM, which was comparable with commercial pyraclostrobin. Structure–activity relationship analysis showed that, with respect to the R1 substituent, the straight chain or cycloalkyl ring moiety was a key structural moiety for the activity, and the R2 substituent on the pyrazole ring could have significant effects on the activity. Simple and readily available pyrazoles with potent antifungal activity were obtained, which are ready for further elaboration to serve as a pharmacophore in new potential antifungal agents.
A Theoretical Analysis of the Differential Chemical Reaction Results Caused by Chirality Induction
Authors: Zhang Feng-Yu , Liu Sicheng , Huang Anwei , Li Yi-Ning , Liu Xiao-Yan , Zhang Peng
Published: August 2023

The theory of electron spin has been proposed for a century, but the study of quantum effects in biological molecules is still in its infancy. Chirality-induced spin selectivity (CISS) is a very modern theory that can explain many biochemical phenomena. In this paper, we propose a new theoretical model based on CISS theory and quantum chemistry theory, which can well explain the theoretical explanation of the chiral selectivity of chiral proteins. Moreover, this theory can predict the spin state of corresponding chiral molecules. Taking the L-DOPA and AADC enzymes as examples, this theoretical model elucidates the AADC enzyme’s chiral catalysis selectivity and successfully predicts the spin state of L-DOPA and D-DOPA’s valence electrons.
In Situ N, O-Dually Doped Nanoporous Biochar Derived from Waste Eutrophic Spirulina for High-Performance Supercapacitors
Authors: Geng Yihao , Wang Jieni , Chen Xuanyu , Wang Qizhao , Zhang Shuqin , Tian Yijun , Liu Chenxiao , Wang Lin , Wei Zhangdong , Cao Leichang , Zhang Jinglai , Zhang Shicheng
Published: August 2023

Sustainable and high-performance energy storage materials are crucial to address global energy and environmental challenges. In this study, Spirulina platensis was used as the carbon and nitrogen source, and Spirulina-based nanoporous biochar (SNPB) was synthesized through chemical activation using KOH as the activating agent in N2 atmosphere. SNPB-800-4 was characterized by N2 adsorption–desorption and XPS, showing a high specific surface area (2923.7 m2 g−1) and abundant heteroatomic oxygen (13.78%) and nitrogen (2.55%). SNPB-800-4 demonstrated an exceptional capacitance of 348 F g−1 at a current density of 1 A g−1 and a remarkable capacitance retention of 94.14% after 10,000 cycles at a current density of 10 A g−1 in 6 M KOH. Notably, symmetric supercapacitors SNPB-800-4//SNPB-800-4 achieved the maximum energy and power densities of 17.99 Wh kg−1 and 162.48 W kg−1, respectively, at a current density of 0.5 A g−1, and still maintained 2.66 Wh kg−1 when the power density was increased to 9685.08 W kg−1 at a current density of 30 A g−1. This work provides an easily scalable and straightforward way to convert waste algae biomass into in situ N, O-dually doped biochar for ultra-high-power supercapacitors.
Probing the Activity Enhancement of Carbocatalyst with the Anchoring of Atomic Metal
Authors: Zhang Zhe , Huang Jie , Chen Wei , Hao Jufang , Xi Jiangbo , Xiao Jian , He Baojiang , Chen Jun
Published: August 2023

Enhanced catalysis for organic transformation is essential for the synthesis of high-value compounds. Atomic metal species recently emerged as highly effective catalysts for organic reactions with high activity and metal utilization. However, developing efficient atomic catalysts is always an attractive and challenging topic in the modern chemical industry. In this work, we report the preparation and activity enhancement of nitrogen- and sulfur-codoped holey graphene (NSHG) with the anchoring of atomic metal Pd. When employed as the catalyst for nitroarenes reduction reactions, the resultant Pd/NSHG composite exhibits remarkably high catalytic activity due to the co-existence of dual-active components (i.e., catalytically active NSHG support and homogeneous dispersion of atomic metal Pd). In the catalytic 4-nitrophenol (4-NP) reduction reaction, the efficiency (turnover frequency) is 3.99 × 10−2 mmol 4-NP/(mg cat.·min), which is better than that of metal-free nitrogen-doped holey graphene (NHG) (2.3 × 10−3 mmol 4-NP/(mg cat.·min)) and NSHG carbocatalyst (3.8 × 10−3 mmol 4-NP/(mg cat.·min)), the conventional Pd/C and other reported metal-based catalysts. This work provides a rational design strategy for the atomic metal catalysts loaded on active doped graphene support. The resultant Pd/NSHG dual-active component catalyst (DACC) is also anticipated to bring great application potentials for a broad range of organic fields, such as organic synthesis, environment treatment, energy storage and conversion.
Thermally Stable Ceramic-Salt Electrolytes for Li Metal Batteries Produced from Cold Sintering Using DMF/Water Mixture Solvents
Authors: Kim Sunwoo , Gim Yejin , Lee Wonho
Published: August 2023

The cold sintering process (CSP) for synthesizing oxide-based electrolytes, which uses water transient solvents and uniaxial pressure, is a promising alternative to the conventional high temperature sintering process due to its low temperature (<200 °C) and short processing time (<2 h). However, the formation of amorphous secondary phases in the intergranular regions, which results in poor ionic conductivity (σ), remains a challenge. In this study, we introduced high-boiling solvents of dimethylformamide (DMF, b.p.: 153 °C) and dimethyl sulfoxide (DMSO, b.p.: 189 °C) as transient solvents to develop composite electrolytes of Li1.5Al0.5Ge1.5(PO4)3 (LAGP) with bis(trifluoromethane)sulfonimide lithium salt (LiTFSI). Our results show that composite electrolytes processed with the DMF/water mixture (CSP LAGP-LiTFSI DMF/H2O) yield a high σ of 10−4 S cm−1 at room temperature and high relative densities of >87%. Furthermore, the composite electrolytes exhibit good thermal stability; the σ maintains its initial value after heat treatment. In contrast, the composite electrolytes processed with the DMSO/water mixture and water alone show thermal degradation. The CSP LAGP-LiTFSI DMF/H2O composite electrolytes exhibit long-term stability, showing no signs of short circuiting after 350 h at 0.1 mAh cm−2 in Li symmetric cells. Our work highlights the importance of selecting appropriate transient solvents for producing efficient and stable composite electrolytes using CSP.
Atrial Fibrillation and Reperfusion Therapy in Acute Ischaemic Stroke Patients: Prevalence and Outcomes—A Comprehensive Systematic Review and Meta-Analysis
Authors: Patel Jay , Bhaskar Sonu M. M.
Published: August 2023

Atrial fibrillation (AF) significantly contributes to acute ischaemic stroke (AIS), yet its precise influence on clinical outcomes post-intravenous thrombolysis (IVT) and post-endovascular thrombectomy (EVT) has remained elusive. Furthermore, the overall prevalence of AF in AIS patients undergoing reperfusion therapy has not been clearly determined. Employing random-effects meta-analyses, this research aimed to estimate the pooled prevalence of AF among AIS patients undergoing reperfusion therapy, while also examining the association between AF and clinical outcomes such as functional outcomes, symptomatic intracerebral haemorrhage (sICH) and mortality. Studies comparing AF and non-AF patient groups undergoing reperfusion therapy were identified and included following an extensive database search. Forty-nine studies (n = 66,887) were included. Among IVT patients, the prevalence of AF was 31% (Effect Size [ES] 0.31 [95%CI 0.28–0.35], p < 0.01), while in EVT patients, it reached 42% (ES 0.42 [95%CI 0.38–0.46], p < 0.01), and in bridging therapy (BT) patients, it stood at 36% (ES 0.36 [95%CI 0.28–0.43], p < 0.01). AF was associated with significantly lower odds of favourable 90-day functional outcomes post IVT (Odds Ratio [OR] 0.512 [95%CI 0.376–0.696], p < 0.001), but not post EVT (OR 0.826 [95%CI 0.651–1.049], p = 0.117). Our comprehensive meta-analysis highlights the varying prevalence of AF among different reperfusion therapies and its differential impact on patient outcomes. The highest pooled prevalence of AF was observed in EVT patients, followed by BT and IVT patients. Interestingly, our analysis revealed that AF was significantly associated with poorer clinical outcomes following IVT. Such an association was not observed following EVT.
Positive Regulation of Acetate in Adipocyte Differentiation and Lipid Deposition in Obese Mice
Authors: Sun Changbao , Li Ang , Wang Huan , Ma Jiage , Hou Juncai
Published: August 2023

Acetate is associated with adipocyte differentiation and lipid deposition. To further develop this scientific point, obese mice on a high-fat diet were given an intragastric administration of acetate for 8 weeks and mouse adipose mesenchymal stem cells (mAMSCs) were treated with acetate for 24 h. The results showed that the body weight, food intake, Lee’s index, adipose tissue coefficient, liver index, blood lipid levels, insulin resistance, pro-inflammatory factors levels and fatty lesions in liver and adipose tissue in obese mice treated with acetate increased markedly, while anti-inflammatory factors levels and liver function decreased significantly (p < 0.05). The mRNA expression levels of PPAR-γ, C/EBP-α, SREBP, AFABP, FAS, ACC-1, SCD-1, LPL, LEPR, GPR41 and GPR43 genes in adipose tissue and mAMSCs were significantly increased, while the mRNA expression levels of HSL, CPT-1, CPT-2, AMPK, AdipoR1 and AdipoR2 genes were significantly reduced (p < 0.05). Except for AMPK-α signaling pathway proteins, the phosphorylation levels of p38 MAPK, ERK1/2, JNK and mTOR were significantly increased (p < 0.05) and these changes were dose-dependent. The findings indicated that acetate played a positive role in regulating adipocyte differentiation and lipid deposition by activating MAPKs and mTOR signaling pathways (the expression up-regulation of genes such as PPAR-γ, C/EBP-α and SREBP-1, etc.) and inhibiting the AMPK signaling pathway (the expression down-regulation of genes such as HSL, CPT-1 and AMPK-α, etc.).
Challenges and Opportunities for Equity in US School Meal Programs: A Scoping Review of Qualitative Literature Regarding the COVID-19 Emergency
Authors: Harper Kaitlyn , Bode Bree , Gupta Kritika , Terhaar Ally , Baltaci Aysegul , Asada Yuka , Lane Hannah
Published: August 2023

The emergency school meals program provided free meals to children in the United States (US) during COVID-19-related school closures. This scoping review aims to synthesize the existing qualitative empirical evidence published between March 2020 and January 2023 on the operations and utilization of emergency school meal programs during the pandemic. Qualitative, US-based peer-reviewed literature was collected from three sources: (1) parent review of all federal nutrition assistance programs; (2) systematic search of four databases; and (3) manual search of grey literature. Identified scientific articles and grey literature reports (n = 183) were uploaded into Covidence and screened for duplicates and inclusion/exclusion criteria. Our final sample included 21 articles/reports, including 14 mixed methods and seven qualitative-only projects. Articles spanned all U.S. states. Articles had similar research questions to understand school meals and/or general food access during COVID-19, with an emphasis on long-term policy implications. Hybrid deductive/inductive analytic coding was used to analyze data, utilizing domains from the Getting to Equity Framework (GTE). GTE considers multi-level factors that influence nutrition behavior while centering more equitable pathways to improve nutrition security and reduce adverse health. Findings were sorted into two categories: operational challenges during the pandemic and solutions to address inequities in school meal distribution during and after the pandemic, particularly during school closures such as summers or future emergencies. Key challenges related to supply chain issues, safety, and balancing families’ needs with limited staff capacity. Programs addressed equity by (a) reducing deterrents through federally issued waivers and increased communications which allowed the serving of meals by programs to families who previously did not have access, (b) building community capacity through collaborations and partnerships which allowed for increased distribution, and (c) preparing and distributing healthy options unless barriers in supply chain superseded the effort. This review highlights the importance of emergency school meal programs and provides insights into addressing challenges and promoting equity in future out-of-school times. These insights could be applied to policy and practice change to optimize program budgets, increase reach equitably, and improve access to nutritious meals among populations at highest risk for nutrition insecurity.
Olive Mill Wastewater as Source of Polyphenols with Nutraceutical Properties
Authors: Cuffaro Doretta , Bertolini Andrea , Bertini Simone , Ricci Claudio , Cascone Maria Grazia , Danti Serena , Saba Alessandro , Macchia Marco , Digiacomo Maria
Published: August 2023

Background: Agrifood waste products are often considered rich sources of bioactive compounds that can be conveniently recovered. Due to these peculiar characteristics, the study of these waste products is attracting great interest in nutraceutical research. Olive mill wastewaters (OMWWs) are generated by extra virgin olive oil (EVOO) production, and they pose environmental challenges due to their disposal. This study aimed to characterize the polyphenolic profile and to evaluate the nutraceutical properties of OMWW extracts from two Tuscan olive cultivars, Leccino (CL) and Frantoio (CF), collected during different time points in EVOO production. Method: After a liquid–liquid extraction, the HPLC and LC–MS/MS analysis of OMWW extracts confirmed the presence of 18 polyphenolic compounds. Results: The polyphenol composition varied between the cultivars and during maturation stages. Notably, oleacein was detected at remarkably high levels in CL1 and CF1 extracts (314.628 ± 19.535 and 227.273 ± 3.974 μg/mg, respectively). All samples demonstrated scavenging effects on free radicals (DPPH and ABTS assays) and an anti-inflammatory potential by inhibiting cyclooxygenase (COX) enzymes. Conclusions: This study highlights the nutraceutical potential of OMWW extracts, emphasizing their antioxidant, antiradical, and anti-inflammatory activities. The results demonstrate the influence of olive cultivar, maturation stage, and extraction process on the polyphenolic composition and the bioactivity of OMWW extracts. These findings support a more profitable reuse of OMWW as an innovative, renewable, and low-cost source of dietary polyphenols with potential applications as functional ingredients in the development of dietary supplements, as well as in the pharmaceutical and cosmetics industries.