bluuebunny/crossref_metadata_2025_split huggingface dataset:
Sleep‐disordered breathing on respiratory polygraphy in neonates with spina bifida
Authors: Wachsmuth Lorine , Bieli Christian , Grehten Patrice , Moehrlen Theres , Moehrlen Ueli , Bernet Vera , Hagmann Cornelia ,   Spina Bifida Study Group Zurich, Grass Beate 
Published: June 2024

AbstractIntroductionStudies have shown a high prevalence of sleep‐disordered breathing (SDB) in children with spina bifida. International standards for regular testing for SDB in this population are lacking. While there are studies investigating the prevalence of SDB in children with spina bifida, there are close to no studies in neonates.Aim and ObjectiveTo evaluate if routine respiratory polygraphy (RPG) testing is indicated for neonates with spina bifida and if yes, with what therapeutic consequence.MethodsWe conducted a retrospective cohort study of all neonates with spina bifida at the University (Children's) Hospital Zurich after fetal spina bifida repair born between 2017 and 2022, who had undergone at least 1 RPG evaluation during hospitalization on the neonatal ward. RPG were evaluated by a blinded group of experienced pediatric pulmonologists. Based on the neonatal RPG results and pediatric pulmonologist's recommendation for caffeine therapy the spina bifida cohort was divided into two groups. Neonatal baseline RPG and follow‐up RPG at the age of the 3 months were evaluated.Results48 neonates with RPG were included. Compared to the standard values in healthy neonates, the RPG results of this spina bifida cohort showed findings of SDB with central apnea and hypopnea. 22 (45.8%) neonatal RPG evaluations detected central SDB, prompting caffeine therapy. Follow‐up RPG conducted after 3 months showed significant improvement of SDB with (almost) no need for continuation of caffeine.ConclusionWe recommend the implementation of routine RPG testing in neonates with spina bifida to detect SDB and facilitate early targeted treatment.
How to Control Excited‐State Prototropism of Photoacids via the Acidity of Ionic Liquids
Authors: Kasana Preeti , Saloni  , Kumar Vinod 
Published: June 2024

AbstractTo control presence of ionic species in excited state of a fluorophore is quite challenging task. Herein, we report the unusual excited‐state prototropism of an important photoacid carbazole dissolved in water in presence of small amount of added ionic liquids (ILs). We have observed that the excited state prototropic equillibria of carbazole dissolved in water can be affected by the presence of small amount of added ILs. More importantly, the excited‐state prototropism of carbazole can be controlled via the acidity of added ILs. More specifically, we found that the fluorescence emission from the neutral prototropic form of carbazole can be observed even under highly basic conditions (aqueous NaOH, pH 12.6) in presence of only small amount of any of the added ILs such as 1‐butyl‐3‐methyl imidazolium tetrafluoroborate ([bmim][BF4]), 1‐butyl‐1‐methylpyrrolidinium bis(trifluromethansulphonyl)imide ([bmpyrr][Tf2N]) and 1‐butyl‐3‐methyl imidazolium hexafluorophosphate ([bmim][PF6]). The observed fluorescence emission from the neutral form of carbazole can be attributed to excited state protonation of carbazole anion by taking proton from IL cation. In a true sense, the excited state carbazole does not transfer the proton; rather takes the proton from IL cation. The observed unusual excited state protonation of carbazole anion to neutral carbazole, in the excited state even in highly basic conditions can be attributed to the presence of acidic protons with the IL cations. Herein, we reports quite unusual results where the IL assisted excited state protonation of carbazole anion occured in an exclusive manner in which proton from the IL cation exclusively protonate carbazole anion surrounded by highly alkaline media (water, pH 12.6). ILs acidity controlled excited‐state properties of important photoacids can have a wide range of chemical and biological applications and the observed results can play important roles in chemical technology to control prototropic equillibra with the help of ILs for some specific application. These observations can open new windows to attract more applications for these alternative solvent media to applications in pH and pOH jump experiments, effective photo protecting agents and chemical lasers.
Effect of Chitosan‐Silver Nanoparticles on DEN‐induced Hepatocellular Injury by Regulation of Wnt/β‐Catenin and Apoptosis Signaling Pathways in Rats
Authors: Nasef Shaimaa M. , Mohamed Hebatallah E. , Mansour Somya Z. 
Published: June 2024

AbstractSilver nanoparticles (AgNPs) have gained remarkable attention as therapeutic agents since the appearance of nanotechnology. This study aims to assess the protective impact of chitosan‐silver nanoparticles (CS‐AgNPs) against DEN‐induced hepatocellular injury by regulation of Wnt/β‐Catenin and apoptosis signaling pathways in rats. CS‐AgNPs solutions were prepared by mixing different concentrations of chitosan and silver nitrate, and then subjected to gamma radiation at 20 kGy. The formation of CS‐AgNPs could be observed by naked eyes from the colour change from light yellow to reddish‐brown, and confirmed by dynamic light scattering (DLS) and transmission electron microscopy (TEM). Stability measurements confirmed that the prepared Cs‐AgNPs are highly stable for around 8 weeks. A crystal violet cytotoxicity assay of CS‐AgNPs has been detected in vitro on HepG2 hepatocellular carcinoma cell lines. The obtained results confirmed the selective influence of CS‐AgNPs on the HCC cell line in a time and dose dependent manner. Diethylnitrosamine (DEN) induced a marked increase in the expressions of Wnt, β‐Catenin, STAT3, MMP9, and Bcl‐2 with a significant decrease in the expression of BAX, p53, and P21. Additionally, DEN significantly decreased the levels of Cytc and TPTH while significantly increased the levels of COX‐2, PGE2, TGF‐1, AFP, and liver enzyme activity. The role of CS‐AgNPs is documented in diminishing the expressions of Wnt, β‐Catenin, STAT3, MMP9, and Bcl‐2. Also, CS‐AgNPs induced the decrease in the levels of COX‐2, PGE2, TGF‐1, AFP and liver enzyme activity accompanied by increased apoptosis. These results concluded that CS‐AgNPs might be a promising drug designed for treating liver diseases.
Semisynthesis: An Essential Tool for Antibiotics Drug Discovery
Authors: Goel Bharat , Tripathi Nancy , Bhardwaj Nivedita , Pal Singh Inder , Jain Shreyans K. 
Published: June 2024

AbstractThe continuous emergence of antimicrobial resistance (AMR) is a serious threat to humans. The discovery and development of new antibiotics having new modes of action are the global need to save mankind. Natural products (NPs) have played a central role in antibiotics drug discovery. Although biologically active, natural products pose some critical issues in their therapeutic uses, including supply issues, pharmacokinetic properties, drug resistance, and toxicity. Semisynthesis holds promise in the discovery and development of antibiotics, offering a strategic approach to overcome challenges associated with antibiotic resistance and optimize the therapeutic properties of existing compounds. Semisynthesis strategies have been used to improve the antimicrobial activities of natural products. By modifying natural compounds, researchers can create derivatives that target specific bacterial pathways or mechanisms, potentially expanding the range of bacterial infections that can be effectively treated with an increased spectrum of resistance. The present review describes NP‐derived semisynthetic antibiotics approved between 1981 and 2022.
Unveiling the Multifaceted Nature of 4‐(4‐Methylphenyl Thio)benzophenone: Electronic Structure and Excited States in Gas Phase and Solvents
Authors: Bhatia Manjeet 
Published: June 2024

AbstractBenzophenone and its derivatives are widely used as UV filters and UV‐ink photoinitiators. The photoinitiating properties of benzophenones depend on their degree of conjugation and delocalization within the molecule. By understanding how conjugation, delocalization, and different substituents affect these properties, benzophenone derivatives can be customized for specific applications. Using quantum mechanical calculations based on B3LYP/6‐311++G(d, p) density functional theory (DFT), chemical reactivity, stability, and photoinitiating capabilities of 4‐(4‐methylphenylthio)benzophenone are analyzed. This includes studying its physical and chemical properties in the gas phase, as well as its excited state electronic transitions, vibrational characteristics, and spectroscopic properties both in gas phase and in various solvents. The DFT‐computed infrared spectra match experimental results. The UV/Visible spectra shows absorption towards longer wavelengths due to extended delocalization of π‐electrons. In different solvents with varying polarity, the absorption spectra exhibit high‐intensity peaks, shift in excitation energy and wavelengths based on the polarity of the solvent. This knowledge allows for the development of novel initiators with customized light absorption, excited state lifetimes, and reaction selectivities, which can enhance processes like UV‐curing, photopolymerization, and other light‐driven reactions.
Growth of ZnO thin Films from Depleted Batteries for Water Remediation
Authors: Melia L. F. , Gallegos M. V. , Juncal L. , Rabal S. , Hernández‐Fenollosa M. A. , Ibañez F. J. , Meyer M. , Damonte L. C. 
Published: June 2024

AbstractZnO films were obtained by electrodeposition technique from commercial Zn2+ solutions and those obtained from spent alkaline batteries. The type of counterion and pH impact directly on the structural, morphological, and optical properties of the electrodeposited ZnO films. The morphological and crystallographic orientation differences observed by X‐ray diffraction (XRD) analysis and high‐resolution field emission scanning electron microscopy (HR‐FESEM), demonstrates the influence of the type and origin of precursors used in the ZnO synthesis process. Those samples grown from commercial nitrate solutions exhibit nanocolumns revealing a preferential growth in the (002) direction. On the other hand, random growth (hexagonal plates, agglomerations, clusters, etc.) is observed in samples obtained through recycled solutions. All deposited samples achieved a transparency close to 80 % and an optical band gap of around 3.30 eV. The as‐deposited films were evaluated toward the photodegradation capacity of methylene blue (MB) for potential technological applications. Results exhibit that samples prepared from recycled ZnCl2 solutions presented more than 80 % degradation per mass of ZnO. This work demonstrates a virtuous circle since ZnO films are deposited by a facile and scalable technique from discarded batteries and used for MB photodegradation. Furthermore, the simplicity of recovery of these substrates after application makes them an attractive and pragmatic option for a range of water treatment applications. Synopsis: Zinc from depleted alkaline batteries is reused to obtain ZnO thin films that remove contaminating dyes from water.
Tunable Synthesis of Pyrazolo Oxepines, Pyrazolo Thiophenes and 1H‐Indazoles Using Alkylation, Aldol Condensation and Thermal Rearrangement
Authors: Pitchai Manivel , Ulaganathan Sankar , Reddy Thirupala , Chikkananjaiah Nanjundaswamy Kanikahalli , Venkateshappa Suresh Shagathur , Byri Vijay Kumar , Akunuri Arun , Pavan Mysore S. , Vetrichelvan Muthalagu , Mathur Arvind , Gupta Anuradha 
Published: June 2024

AbstractBase‐mediated alkylation of 1‐alkyl/aryl‐5‐hydroxy/mercapto‐1H‐pyrazole‐4‐carbaldehydes with functionalized 3‐bromo‐prop‐1‐enes and 3‐bromo‐1‐(arylsulfonyl)propenes followed by intra‐molecular cyclization afforded regioselective pyrazolo oxepines, pyrazolo thiophenes, and 1H indazoles respectively, with good to excellent yields. This protocol paves the way for the development of syntheses of interesting biologically active scaffolds.
Revolutionizing Indole Synthesis: A Microwave‐Powered Approach
Authors: Nigam Vaibhav , Singh Surbhi , Kasana Shivani , Kumar Shivam , Das Kurmi Balak , Das Gupta Ghanshyam , Patel Preeti 
Published: June 2024

AbstractTempted by the unique medicinal and biological potential of indole‐containing heterocycles, chemists, especially those specializing in heterocycle synthesis and drug discovery, are actively pursuing their efficient construction. This review spotlights the latest advancements in microwave‐assisted (M. W.) synthesis of diverse indole‐based heterocyclic compounds. We systematically categorize the reported methods based on the specific indole substitution patterns. This review concise the microwave assisted synthesis of indole based‐pyridine derivatives, indole based‐pyrimidine, indole based‐oxindole, spiro‐oxindole, Fischer indole Heck‐isomerization derivatives, functionalized indole, substituted indoles, indolyl quinoline, indole triazole and indolylnicotinonitriles derivatives. Ultimately, this review aims to provide organic and medicinal chemists with a concise yet informative guide to recent methodologies employing indole derivatives in the microwave‐powered synthesis of heterocycles.
Hybrid mutation driven testing for natural language inference
Authors: Meng Linghan , Li Yanhui , Chen Lin , Ma Mingliang , Zhou Yuming , Xu Baowen 
Published: June 2024

SummaryNatural language inference (NLI) is a task to infer the relationship between the premise and hypothesis sentences, whose models have essential applications in the many natural language processing (NLP) fields, for example, machine reading comprehension and recognizing textual entailment. Due to the data‐driven programming paradigm, bugs inevitably occur in NLI models during the application process, which calls for novel automatic testing techniques to deal with NLI testing challenges. The main difficulty in achieving automatic testing for NLI models is the oracle problem; that is, it may be too expensive to label NLI model inputs manually and hence be too challenging to verify the correctness of model outputs. To tackle the oracle problem, this study proposes a novel automatic testing method hybrid mutation driven testing (HMT), which extends the mutation idea applied in other NLP domains successfully. Specifically, as there are two sets of sentences, that is, premise and hypothesis, to be mutated, we propose four mutation operators to achieve the hybrid mutation strategy, which mutate the premise and the hypothesis sentences jointly or individually. We assume that the mutation would not affect the outputs; that is, if the original and mutated outputs are inconsistent, inconsistency bugs could be detected without knowing the true labels. To evaluate our method HMT, we conduct experiments on two widely used datasets with two advanced models and generate more than 520,000 mutations by applying our mutation operators. Our experimental results show that (a) our method, HMT, can effectively generate mutated testing samples, (b) our method can effectively trigger the inconsistency bugs of the NLI models, and (c) all four mutation operators can independently trigger inconsistency bugs.
Two sides of the same coin: A study on developers' perception of defects
Authors: Santos Geanderson , Muzetti Igor , Figueiredo Eduardo 
Published: June 2024

SummarySoftware defect prediction is a subject of study involving the interplay of software engineering and machine learning. The current literature proposed numerous machine learning models to predict software defects from software data, such as commits and code metrics. Further, the most recent literature employs explainability techniques to understand why machine learning models made such predictions (i.e., predicting the likelihood of a defect). As a result, developers are expected to reason on the software features that may relate to defects in the source code. However, little is known about the developers' perception of these machine learning models and their explanations. To explore this issue, we focus on a survey with experienced developers to understand how they evaluate each quality attribute for the defect prediction. We chose the developers based on their contributions at GitHub, where they contributed to at least 10 repositories in the past 2 years. The results show that developers tend to evaluate code complexity as the most important quality attribute to avoid defects compared with the other target attributes such as source code size, coupling, and documentation. At the end, a thematic analysis reveals that developers evaluate testing the code as a relevant aspect not covered by the static software features. We conclude that, qualitatively, there exists a misalignment between developers' perceptions and the outputs of machine learning models. For instance, while machine learning models assign high importance to documentation, developers often overlook documentation and prioritize assessing the complexity of the code instead.
Trajectory tracking attack for vehicular ad‐hoc networks
Authors: Li Changrong , Li Zhenfu 
Published: June 2024

AbstractMaintaining user privacy and security is a critical concern in vehicular ad hoc networks (VANETs). However, prior research has neglected the study of matrix recovery attack methods in VANETs and the challenge of reducing the number of roadside units (RSUs). In this article, we formulate a path recovery strategy using matrix recovery techniques from an adversarial view. Subsequently, the challenge of minimizing RSUs while monitoring all user vehicles in a region is converted into a set cover problem. We introduce a heuristic algorithm that utilizes clustering to address this issue. To minimize matrix recovery errors, a Kalman filter based method is integrated to enhance the performance. This paper also presents an initial deployment of path recovery attacks, maintaining effectiveness even with certain defense mechanisms in place. Furthermore, we conduct simulation experiments to evaluate the effectiveness of the proposed attack strategy. The simulation results demonstrate the performance across various dimensions. Finally, the results show that the success rate of our proposed counter‐defense strategy in overcoming user defenses surpasses 50%.
Experimental and analytical study on the load‐bearing capacity of segmented tower structures with dry joints under combined loading
Authors: Fürll Florian , Klein Fabian , Hartwig Steffen , Kang Chongjie , Betz Thorsten , Marx Steffen 
Published: June 2024

AbstractIn recent years, hybrid towers have become increasingly established, especially for tall wind turbines. The concrete part of these towers, commonly constructed using segmental construction methods, consists of several circular ring segments stacked on top of each other. To reduce the amount of fabrication and erection effort, the joints between the segments are typically designed as dry ground joints. This paper deals with experimental investigations to determine the torsional load‐bearing capacity of such dry ground concrete joints subjected to combined loading of prestressing, bending, and torsion. Based on the experience of previous investigations, a test set‐up consisting of three reinforced concrete segments with circular ring cross‐sections was developed. The herein newly developed evaluation concept enabled precise identification of the failure point for each test run utilizing the measured tangential displacements of the joint. The test results clarify the weaknesses of the current design model regarding the insufficient interaction with the bending moment and show very good accordance with the new calculation model, the so‐called fiber model.
Experimental verification of full‐scale silo structure demolition: Investigating successive column removal with finite element method and progressive collapse simulation through blast load
Authors: Yuzbasi Julide 
Published: June 2024

AbstractThis article presents an experimental and numerical study of the collapse behavior of a 60‐m‐high cement silo structure under blast loading, analyzed using SAP2000 (FEM‐NDA) and LS‐DYNA (FEM‐NDA‐explicit code) models to simulate the collapse mechanism. Considering the seismic events in Kahramanmaras, Turkiye, on February 6, 2023, with magnitudes of 7.8 and 7.6, the necessity for the explosive demolition of hundreds of thousands of structures has underscored the urgency of rapid planning. This situation requires a particular focus on the expeditious analysis of demolition methodologies. The study includes pre‐planning stages, sudden column removals and the detonation of columns with blast loads for the controlled demolition of a full‐scale existing silo structure. To overturn the structure, the columns inside the wedge region were suddenly removed using SAP2000 nonlinear dynamic analysis (NDA) to understand the subsequent load redistribution. A study was conducted to compare the use of shell and plate elements in SAP2000 for a 1‐m‐thick wall silo. The results showed that using shell elements provided relatively closer results to real values than plate elements. For the explicit analysis part, the structural components were modeled as solid materials, and columns were detonated with blast loads. The models and actual demolition frame‐by‐frame results of the structure were compared, and the numerical model's accuracy was validated using experimental data from stationary cameras and drones, with the explicit analysis results found to be in agreement. While explicit analysis yielded results more in line with real data, SAP2000 NDA provided relatively distant results, although SAP2000‐NDA was more time‐efficient compared to explicit analysis models. However, a preliminary evaluation can be made if the characteristics of both programs are understood. The documented information on full‐scale structure demolition and findings presented in this paper will serve as a resource for future studies and provide a reference for researchers.
The effect of incidental dose to pelvic nodes in bladder-only irradiation in the era of IMRT: a dosimetric study
Authors: Ozyigit Gokhan , Kahvecioglu Alper , Cengiz Mustafa , Yedekci Fazli Yagiz , Hurmuz Pervin 
Published: June 2024

Abstract
Purpose
While three-dimensional radiotherapy (RT) causes high incidental nodal doses in bladder-only irradiation for muscle-invasive bladder cancer (MIBC), the impact on pelvic lymphatics is unclear in the era of intensity-modulated RT (IMRT). This study evaluates incidental doses to pelvic lymphatics in MIBC patients treated with IMRT.

Methods
The data of 40 MIBC patients treated with bladder-only IMRT and concurrent chemotherapy were retrospectively evaluated. The pelvic lymphatics were contoured on initial simulation images and incidental nodal doses were evaluated. The Statistical Package for the Social Sciences (SPSS) version 23.0 (IBM, Armonk, NY, USA) was used for statistics.

Results
Median RT dose to the bladder was 60 Gy in 30 fractions. In dosimetric analysis, median values of mean dose (Dmean) of the obturator, presacral, external iliac, internal iliac, and distal common iliac lymphatics were 33 Gy (range 4–50 Gy), 3 Gy (range 1–28 Gy), 9.5 Gy (range 3–41 Gy), 7.5 Gy (range 2–14 Gy), and 1 Gy (range 0–15 Gy), respectively. The Dmean of the obturator lymphatics was significantly higher (p < 0.001) and the Dmean of the distal common iliac lymphatics was significantly lower (p < 0.001) than all remaining lymphatic stations. The Dmean of the external iliac lymphatics was significantly higher than that of the presacral lymphatics (p < 0.001), but the difference with the internal iliac lymphatics was not statistically significant (p = 0.563).

Conclusion
The incidental nodal doses with bladder-only IMRT are heterogeneous and remain below the generally accepted doses for microscopic disease eradication for bladder cancer.