bluuebunny/crossref_metadata_2025_split huggingface dataset:
Enhanced Adsorption Kinetics and Capacity of a Stable CeF3@Ni3N Heterostructure for Methanol Electro‐Reforming Coupled with Hydrogen Production
Authors: Deng Kuan , Liu Xuesong , Liu Peng , Lv Xingbin , Tian Wen , Ji Junyi 
Published: November 2024

AbstractAlkaline methanol‐water electrolysis system is regarded as an appealing strategy for electro‐reforming methanol into formate and producing hydrogen with low energy‐consumption compared with alkaline water electrolysis. However, stability and selectivity under high current densities for practical application remain challenging. Herein, a CeF3@Ni3N nanosheets array anchored on carbon cloth (CeF3@Ni3N/CC) was fabricated. The gradual extrusion of F species from Ni(OH)2 lattices can stabilize hierarchical structure and construct abundant heterostructure interfaces. Moreover, CeF3 can modulate electron distribution of Ni3N, thus simultaneously enhancing the surface adsorption kinetics and capability of methanol and OH−, which is conducive to enhanced methanol oxidation reaction (MOR) activity and selectivity. Therefore, bifunctional CeF3@Ni3N/CC exhibits low potential of 1.43 V at 500 mA cm−2, along with high stability over 72 h and high faradaic efficiency (FEs) in MOR, as well as an overpotential of 76 mV to achieve 50 mA cm−2 for hydrogen evolution reaction (HER). Furthermore, membrane‐free CeF3@Ni3N/CC||CeF3@Ni3N/CC cell for MOR||HER delivers high electrocatalytic activity, long‐term stability and FEs at high current density of 300 mA cm−2. This study highlights the importance of optimizing surface adsorption behavior of active species, as well as rational design of highly efficient heterostructure electrocatalysts for methanol upgrading coupled with hydrogen production.
Anion‐Tailored EDL Induced Triple‐Layer SEI on High‐Capacity Anodes Enabling Fast‐Charging and Durable Sodium‐Storage
Authors: Luo Jun , Yang Kaiwei , Gai Jingjing , Zhang Xixue , Peng Chengbin , Qin Changdong , Ding Yang , Yuan Yifei , Xie Zhengkun , Yan Pengfei , Cao Yuliang , Lu Jun , Chen Weihua 
Published: November 2024

AbstractHigh‐capacity electrodes face a great challenge of cycling stability due to particle fragmentation induced conductive network failure and accompanied by sustained electrolyte decomposition for repeatedly build solid electrolyte interphase (SEI). Herein, Se‐solubility induced Sex2− as self‐adjustment electrolyte additive to regulate electric double layer (EDL) for constructing novel triple‐layer SEI (inner layer: Se; mediate layer: inorganic; outer layer: organic) on high‐capacity FeS2 anode as an example for achieving stable and fast sodium storage. In detail, Sex2− in situ generated at 1.30 V (vs. Na+/Na) and was preferentially adsorbed onto EDL of anode, then converted to Se0 as inner layer of SEI. In addition, the Sex2− causes anion‐enhanced Na+ solvation structure could produce more inorganic (Se0, NaF) and less organic SEI components. The unique triple‐layer SEI with layer‐by‐layer dense structure alleviate the excessive electrolyte consumption with less gas evolution. As a result, the anode delivered long‐lifespan at 10 A g−1 (383.7 mAh g−1, 6000 cycles, 93.1 %, 5 min/cycle). The Se‐induced triple‐layer SEI could be also be formed on high‐capacity SnS2 anode. This work provides a novel SEI model by anion‐tailored EDL towards stable sodium‐storage of high‐capacity anode for fast‐charging.
Plants, plant‐derived compounds, probiotics, and postbiotics as green agents to fight against poultry coccidiosis: A review
Authors: Chen Pan , Liu Kaili , Yue Taojing , Lu Yanan , Li Senyang , Jian Fuchun , Huang Shucheng 
Published: November 2024

AbstractThe intestinal tract is the main place for animals to digest food and absorb nutrients, which also serves as the first line of defense against pathogens that invade the internal environment. Therefore, normal intestinal structure and function are essential for animal health. Poultry coccidiosis is an intestinal disease primarily caused by the parasitization of intestinal epithelial cells by protozoa of the genus Eimeria. The occurrence of coccidiosis not only compromises the intestinal integrity of poultry but also increases their disease susceptibility, thus posing a serious threat to the overall health and productivity of poultry. Nowadays, the primary methods for controlling and preventing coccidiosis in poultry are anticoccidial drugs or live oocyst vaccines. However, the use of the former may be associated with problems of resistance and drug residues, while the use of the latter may cause intestinal damage and significantly increase farming costs. For these reasons, it is critical to investigate green, safe, and cost‐effective natural alternative strategies such as phytochemicals and probiotics for controlling coccidiosis as well as mitigating the deleterious effects of coccidial infections in production. In this review, we aim to summarize the role, mechanisms, and therapeutic potential of natural products in the treatment of coccidiosis to lay a theoretical foundation for effective coccidiosis control.
Darolutamide in Japanese patients with metastatic hormone‐sensitive prostate cancer: Phase 3 ARASENS subgroup analysis
Authors: Uemura Motohide , Kikukawa Hiroaki , Hashimoto Yasuhiro , Uemura Hiroji , Mizokami Atsushi , Kato Masashi , Matsushima Hisashi , Kosaka Takeo , Nakamura Motonobu , Fukasawa Satoshi , Smith Matthew R. , Tombal Bertrand , Hussain Maha , Saad Fred , Fizazi Karim , Sternberg Cora N. , Crawford E. David , Kakiuchi Haruka , Akiyama Masanao , Li Rui , Kuss Iris , Joensuu Heikki , Suzuki Hiroyoshi 
Published: November 2024

AbstractBackgroundIn the global ARASENS study (NCT02799602), darolutamide plus androgen‐deprivation therapy (ADT) and docetaxel significantly reduced risk of death by 32.5% versus placebo plus ADT and docetaxel (hazard ratio [HR] 0.68; 95% confidence interval [CI] 0.57–0.80; p < 0.0001), with a favorable safety profile in patients with metastatic hormone‐sensitive prostate cancer (mHSPC). We investigated outcomes in Japanese participants.MethodsPatients were randomized 1:1 to oral darolutamide 600 mg twice daily or placebo, plus ADT and docetaxel. The primary endpoint was overall survival.ResultsThe Japanese subgroup comprised 148 patients (darolutamide 63, placebo 85). In the Japanese versus overall population, more patients were aged ≥75 years (darolutamide/placebo 35%/22% vs. 16%/17%) and had body mass index <25 kg/m2 (78%/79% vs. 46%/43%), The ECOG performance status 0 (92%/88% vs. 72%/71%), de novo mHSPC (95%/97% vs. 86%/87%), and Gleason score ≥8 (94%/92% vs. 78%/79%). Median treatment duration was 43.3/15.4 months for darolutamide/placebo. The overall survival HR for darolutamide versus placebo was 0.91 (95% CI 0.50–1.64), despite 85% of patients in the placebo group receiving subsequent life‐prolonging therapy. Darolutamide prolonged time to castration‐resistant prostate cancer (HR 0.31; 95% CI 0.17–0.55). Treatment‐emergent adverse event incidences were generally similar between groups. Adverse events known to be associated with docetaxel (e.g., neutropenia) were more frequent in the Japanese versus overall population.ConclusionIn conclusion, efficacy outcomes showed positive trends for darolutamide plus ADT and docetaxel in Japanese patients with mHSPC, consistent with the overall population, despite higher risk factors. The combination was well tolerated, with no new safety signals in Japanese patients.
Identification and Experimental Validation of Prognostic miRNA Signature and Ferroptosis‐Related Key Genes in Cervical Squamous Cell Carcinoma
Authors: Guo Yan , Han Yana , Zhang Junjie , Zhou Yanbin , Wei Meiyan , Yu Lijun 
Published: November 2024

ABSTRACTObjectivesThis study aimed to investigate the prognostic value of miRNAs and ferroptosis‐related genes in cervical squamous cell carcinoma.MethodsWe mined data from public databases for differentially expressed miRNAs, ferroptosis‐related genes, and clinical parameters and constructed a prognostic risk model. The predictive performance of the model was evaluated using survival and receiver operating characteristic curve analyses. We combined the clinicopathological features to construct a nomogram and evaluated its efficacy using calibration and clinical decision curves. The correlation between miRNA characteristics, risk score, and the tumor microenvironment was also studied. Next, consensus and key genes were screened, and their biological functions were analyzed using KEGG, GO, GSEA, and drug sensitivity analysis. Finally, the expression of miRNAs and key genes was detected using qRT‐PCR and western blotting to verify the prediction results.ResultsSeven miRNA signatures (miR‐100‐3p, miR‐301a‐5p, miR‐331‐3p, miR‐425‐5p, miR‐502‐3p, miR‐505‐5p, and miR‐629‐3p) were generated, and prognostic risk and nomogram models were successfully constructed. These models exhibited good accuracy. miRNA signatures correlated with the tumor microenvironment. Twelve consensus genes and three key genes (SLC2A1, ANO6, and TXNIP) were screened and their biofunctional diversity was identified using various analytical methods. qRT‐PCR and western blotting were used to verify the expression of miR‐301a‐5p, miR‐505‐5p, SLC2A1, and TXNIP in cervical squamous carcinoma. The results were consistent with those of bioinformatics analyses.ConclusionsSeven miRNAs may serve as prognostic biomarkers of cervical squamous cell carcinoma. SLC2A1, ANO6, and TXNIP are associated with cervical squamous cell carcinoma and may serve as ferroptosis‐related markers of the disease.
Enrichment, Antioxidant and Enzyme Inhibition Activities of Flavonoids from Artemisia Selengensis Turcz.
Authors: Wang Ting , Wang Weiming , Shi Zhichun , Wang Dan , Li Jun , Sun Liqiu , Zhao Ming 
Published: November 2024

AbstractMacroporous resin was used to enrich flavonoids in the ethyl acetate extract of Artemisia Selengensis Turcz. Based on a single factor experiment, the enrichment process was optimized using the response surface method. The optimal parameters of the enrichment process were a sample concentration of 0.3 mg/mL, a loading rate of 1 mL/min, an elution flow rate of 2 mL/min, and a total flavonoid content of 155.38±0.97 mg/g. The flavonoids enriched by AB‐8 macroporous resin demonstrated significant scavenging activities against DPPH, ABTS+, and hydroxyl free radicals, and also exhibited certain inhibitory effects on α‐amylase and α‐glucosidase. Among them, the scavenging ability of the flavonoids enriched by AB‐8 macroporous resin on hydroxyl free radical (IC50=30.31±1.92 μg/mL) was the closest to Vc, and the inhibitory effect on α‐glucosidase (IC50=16.19±1.35 μg/mL) was the best. These findings confirmed the potential of Artemisia Selengensis Turcz. was a natural antioxidant and hypoglycemic drug.
Exploring the Antisnake Venom Potential of Zingiber officinale and its Bioactive Compounds Against Naja nigricollis Venom Through Computational Approaches and Experimental Validation
Authors: Yusuf Amina J. , Ibrahim Nasir , Abdullahi Musa I. , Adeboyega Abayomi E. , Salihu Mustapha 
Published: November 2024

AbstractSnakebite envenomation remains a significant medical challenge, particularly in tropical and subtropical regions. The present study investigates the inhibitory potential of Zingiber officinale (ginger) and its bioactive compounds against Naja nigricollis venom using in silico approaches and animal models. No protection was observed in the in vivo studies but the extract of the plant was able to prolong the time of death with mean survival time ranging from 2.01–2.83 hours. In terms of the in vitro studies, the extract was able to significantly (p<0.05) detoxify the N. nigricollis venom by 80 % at the graded doses; standard antisnake venom (ASV) offered 100 % protection to mice. Molecular docking analysis revealed strong binding affinities between the bioactive compounds and the PLA2 enzyme, indicating potential inhibitory effects. The stability and dynamics of the protein‐ligand complexes were further validated through molecular dynamics (MD) simulations, which confirmed the persistence of these interactions over time. In conclusion, the findings suggest that the bioactive compounds from Z. officinale could serve as promising inhibitors of PLA2, providing a foundation for the development of novel snakebite envenomation therapies.
Behavioral health training for integrated behavioral health: A Delphi study
Authors: Schmoyer Nicholas , Corbin Lisa , Huffman Jessica , Kemer Gülşah 
Published: November 2024

AbstractUsing a classical Delphi design, the authors used an interdisciplinary panel of behavioral health experts in integrated behavioral health (IBH) to identify foundational skills and knowledge counselor educators need to teach clinical mental health counselors for IBH practice. Eighty‐eight statements were identified. Implications are provided for counseling and other behavioral health educators.
Modulating the Supramolecular Assembly of α‐Cyclodextrin and Anderson‐type Polyoxometalate through Covalent Modifications
Authors: Liu Chun‐Yan , Mu Yun‐Jing , Chen Wu‐Ji , Yin Yi‐An , Lin Chang‐Gen , Miras Haralampos N. , Song Yu‐Fei 
Published: November 2024

AbstractA series of unprecedented supramolecular complexes of covalently modified Anderson‐type polyoxometalates (POMs) and α‐cyclodextrins (α‐CDs) have been obtained and characterized in solid state by single‐crystal X‐ray diffraction, and in aqueous solution using various techniques including 1H DOSY NMR, 2D NOESY 1H NMR, isothermal titration calorimetry (ITC), and electrospray ionization time‐of‐flight mass spectroscopy (ESI‐TOF‐MS). It has been demonstrated that the supramolecular assembly process could be modulated by different covalent modification modes of the Anderson POMs, giving rise to a new type of POM/α‐CD complexes featuring organic‐inorganic pseudo‐rotaxane structures, which are in good contrast to those of POM/γ‐CD complexes of poly‐rotaxane structures. Moreover, it is delighted to find that these pseudo‐rotaxanes of POM/α‐CD complexes exhibit stable chirality in aqueous solution, which has not been accomplished in previously reported POM/CD assemblies.
Vapour–liquid equilibrium using quantum chemical molecular dynamics simulation and radial distribution function analysis
Authors: Kim Byoung Chul , Jeong Su Yeong , Jin Cho Won , Kim Jeom‐Soo , Kim Young Han 
Published: November 2024

AbstractInstead of the classical molecular simulation widely implemented for estimating the vapour–liquid equilibrium (VLE), a quantum chemical (QC) molecular dynamics simulation was applied to the VLE estimation in three typical systems that include a deep eutectic solvent (DES) and an ionic liquid (IL). In addition, a radial distribution function (RDF) was derived from the QC simulation to examine the molecular behaviour in the liquid phase. A mean absolute error of 2.72% was obtained from the QC simulation compared to the experimental data. The RDF analysis explains the relative volatility increase of the acetic acid and water binary system with the propyl acetate solvent. This analysis indicated that the DES mixture comprising glycerol and choline chloride facilitated the separation of water and i‐propanol. The interaction between water and ethyl sulphate pair with the help of 1‐ethyl‐3‐methylimidazolium as an IL is stronger than that between ethanol and water, which explains how the IL improves ethanol and water separation in the vapour phase.
Copper‐Catalyzed Ring‐Opening Hydrosilylation and Hydroboration of Arylidenecyclopropanes
Authors: Xiao Zhen‐Yu , Wang Zi‐Lu , Xu Yun‐He 
Published: November 2024

Comprehensive SummaryArylidenecyclopropanes (ACPs) are highly strained substrates that can be readily utilized for diverse transformations. This study showcases the outcomes of copper‐catalyzed ring‐opening hydrosilylation and hydroboration reactions of ACPs, showcasing precise cleavage of C—C bonds. The reaction presents an effective and convenient method for producing homoallylic silanes and boronates.
Analyses of Off‐Target Effects on Cardiac and Skeletal Muscles by Berberine, a Drug Used to Treat Cancers and Induce Weight Loss
Authors: Wang Jushuo , Fan Yingli , Dube Syamalima , Benz Patricia , Dube Dipak , Sanger Jean M. , Sanger Joseph W. 
Published: November 2024

ABSTRACTPrevious reports from our laboratory describing the formation of myofibrils in cultured embryonic cardiac and skeletal muscle cells have proposed that myofibrillogenesis occurs in three steps of increasing protein organization: beginning with premyofibrils, followed by nascent myofibrils, and ending in mature myofibrils. Inhibitors of the ubiquitin proteasome system (UPS) prevented nascent myofibrils from progressing directly to mature myofibrils in cultured cardiac and skeletal muscle cells, supporting a three‐step model of assembly in which some of the proteins in nascent myofibrils are proteolyzed to allow the assembly of mature myofibrils. Application of UPS inhibitors on cultured muscle cells suggests possible explanations for the off‐target cardiac and skeletal muscle adverse effects of UPS drugs, which are used on cancer patients. Berberine, a plant derivative, has been used to treat various cancers, including multiple myelomas. In contrast to the use of UPS drugs, success was reported with Berberine in multiple myeloma patients with no off‐target effects on their hearts. We have exposed cultured cardiac and skeletal muscle cells to Berberine, a ligase inhibitor of UHRF1 (ubiquitin‐like with PHD and RING finger domains). Berberine inhibited myofibril assembly at the nascent myofibril stage in embryonic skeletal muscle cells but had no effect in the assembly of mature myofibrils in embryonic heart cells. RT‐PCR experiments demonstrated Berberine inhibition of mRNA for muscle myosin II heavy chains but not for muscle actin mRNA in skeletal muscle cells. Berberine is also being used as a popular weight losing compound, because it is much cheaper and available without a prescription than the semaglutide containing weight losing drugs (Wegovy and Ozempic). In contrast to Berberine, semaglutide had no effects on myofibril assembly in culture assays for both cardiac and skeletal muscle cells. We postulate that analyses of cultured embryonic cardiac and skeletal muscle cells will provide a preclinical assay for the testing of novel cancer drugs with improved outcomes for patients, an important goal for cancer therapeutics.
Structure‐activity‐relationships of the Stability of Six Pentathiepins Towards Glutathione: Possible Correlations with Biological Activities
Authors: Napierkowski Martin , Schöne Tom , Bandaru Siva Sankar Murthy , Judernatz Jo , Schulig Lukas , Schmidt Louis , Schulzke Carola , Bednarski Patrick J. 
Published: November 2024

AbstractThe biological properties of pentathiepins have been intensively studied in recent years. Although the proposed mechanism of action requires activation by intracellular thiols, the dependence of activity on the stability of pentathiepins towards glutathione (GSH) has not been directly investigated. Here, we determined the structure‐related stability of six different pentathiepins with four different scaffolds in the presence of GSH by using reversed‐phase high‐performance liquid chromatography (RP‐HPLC) and UV‐vis spectroscopy over a wide range of GSH concentrations. We found significant differences in compound stability depending on the pentathiepin scaffold; these differences were reflected in their cytotoxic activities. However, we found no substantial differences in their inhibition of glutathione peroxidase 1 (GPx‐1). While the intact pentathiepin ring is necessary for the antiproliferative activity of pentathiepins, the depletion of intracellular GSH content with dl‐buthionine‐(S,R)‐sulfoximine (BSO) led to a significant increase in cytotoxicity of the tested substances. In view of the increased cytotoxicity following artificial GSH depletion, this calls into question the sole role of GSH in the intracellular activation mechanism.
New Indole‐Based Phenylthiazolyl‐2,4‐dihydropyrazolones as Tubulin polymerization inhibitors: Multicomponent Synthesis, Cytotoxicity Evaluation, and in silico Studies
Authors: Bakchi Bulti , Devabattula Geetanjali , Maddipatla Sarvan , Singampalli Anuradha , Kumar Porna Dileep , Nanduri Srinivas , Sharma Anamika , Godugu Chandraiah , Yaddanapudi Venkata Madhavi 
Published: November 2024

AbstractA facile multicomponent synthesis of new indole‐based phenylthiazolyl‐dihydropyrazolone hybrids, their structural characterization, biological evaluation, and in silico investigations as anticancer agents are reported. Lead molecule 5 i of the series showed potent activity against MCF‐7 breast cancer cells with an IC50 of 3.92±0.01 μM while showing minimal toxicity to normal human lung cells (IC50=69.85±3.95 μM). Further studies show that the compound exhibits antiproliferative activity by inducing apoptosis in MCF‐7 cancer cells. The wound healing assay indicated impaired cell migration under the concentration‐dependent dosage. The lead molecule 5 i also successfully inhibited the tubulin polymerase enzyme with an IC50 of 4.16±0.18 μM. A flow cytometric assay indicated compound 5 i induced apoptosis through G0 phase cell cycle arrest. The binding mode and interactions of the compound with the tubulin were predicted by molecular modelling and calculating binding free energies. These findings explain the current series as a new class of microtubule polymerization inhibitors with anticancer activity suitable for developing anticancer agents targeting tubulin.
Parameter Dependency of Electrochemical Reduction of CO2 in Acetonitrile – A Data Driven Approach
Authors: Deacon‐Price Connor , Mijatović Aleksandra , Hoefsloot Huub C. J. , Rothenberg Gadi , Garcia Amanda C. 
Published: November 2024

AbstractThe electrochemical CO2 reduction reaction (CO2RR) is a promising technology for the utilization of captured CO2. Though systems using aqueous electrolytes is the state‐of‐the‐art, CO2RR in aprotic solvents are a promising alternative that can avoid the parallel hydrogen evolution reaction (HER). While system parameters, such as electrolyte composition, electrode material, and applied potential are known to influence the reaction mechanism, there is a lack of intuitive understanding as to how. We show that by using multivariate data analysis on a large dataset collected from the literature, namely random forest modelling, the most important system parameters can be isolated for each possible product. We find that water content, current density, and applied potential are powerful determinants in the reaction pathway, and therefore in the Faradaic efficiency of CO2RR products.