bluuebunny/crossref_metadata_2025 huggingface dataset:
Evaluating E-Teaching Adoption Criteria for Indian Educational Organizations Using Fuzzy Delphi-TOPSIS Approach
Authors: Huang Tsun-Yu , Chen Wen-Kuo , Nalluri Venkateswarlu , Huynh-Cam Thao-Trang
Published: June 2022

Due to advances in information and communication technology, e-teaching has become increasingly popular and is in high demand by educational organizations. During the lockdown period of COVID-19 especially, e-teaching provided prior solutions to address the pressing need for monitoring students’ learning progress. However, in many developing countries, it is apparent that a wide variety of issues are related to e-teaching adoption. Although the implementation issues associated with e-teaching have been addressed in the existing research literature and in practice for many years, from the available research, the evaluation of e-teaching adoption criteria and ranking using fuzzy theory has been ignored. Therefore, the present research aims to evaluate and rank the criteria for e-teaching adoption through Fuzzy Delphi and Fuzzy TOPSIS. A total of four criteria and twelve sub-criteria for e-teaching adoption were determined based on a systematic literature review and professors’ opinions in India. In addition, the Fuzzy Delphi method was employed to finalize the criteria, and the Fuzzy TOPSIS method was employed for ranking the alternatives. The assessment results showed that among the identified alternatives, the “share the technology with other organizations” and “course integration with technology” were the top-ranked alternatives for improving e-teaching adoption. An understanding of these conceptual alternatives can encourage the adoption of e-teaching in educational organizations.
1-O-Alkylglycerol Ethers from the Marine Sponge Guitarra abbotti and Their Cytotoxic Activity
Authors: Dyshlovoy Sergey A. , Fedorov Sergey N. , Svetashev Vasily I. , Makarieva Tatiana N. , Kalinovsky Anatoliy I. , Moiseenko Olga P. , Krasokhin Vladimir B. , Shubina Larisa K. , Guzii Alla G. , von Amsberg Gunhild , Stonik Valentin A.
Published: June 2022

The cytotoxicity-bioassay-guided fractionation of the ethanol extract from the marine sponge Guitarra abbotti, whose 1-O-alkyl-sn-glycerol ethers (AGEs) have not been investigated so far, led to the isolation of a complex lipid fraction containing, along with previously known compounds, six new lipids of the AGE type. The composition of the AGE fraction as well as the structures of 6 new and 22 previously known compounds were established using 1H and 13C NMR, GC/MS, and chemical conversion methods. The new AGEs were identified as: 1-O-(Z-docos-15-enyl)-sn-glycerol (1), 1-O-(Z-docos-17-enyl)-sn-glycerol (2), 1-O-(Z-tricos-15-enyl)-sn-glycerol (3), 1-O-(Z-tricos-16-enyl)-sn-glycerol (4), 1-O-(Z-tricos-17-enyl)-sn-glycerol (5), and 1-O-(Z-tetracos-15-enyl)-sn-glycerol (6). The isolated AGEs show weak cytotoxic activity in THP-1, HL-60, HeLa, DLD-1, SNU C4, SK-MEL-28, and MDA-MB-231 human cancer cells. A further cytotoxicity analysis in JB6 P+ Cl41 cells bearing mutated MAP kinase genes revealed that ERK2 and JNK1 play a cytoprotective role in the cellular response to the AGE-induced cytotoxic effects.
Current Knowledge and Novel Therapeutic Approaches Based on Pharmacokinetics and Pharmacodynamics in Stress-Induced Pathology
Authors: Amalinei Cornelia
Published: June 2022

There have been numerous progresses recently made in the knowledge of different types of stress involvement in human pathology, in an effort to counteract or to prevent their etiopathogenic pathways or to find novel therapeutic approaches [...]
Apocrine Hidrocystoma with IgG4 Plasma Cell Infiltration Presenting as Recurrent Chalazion: A Case Report
Authors: Wu Shang-Yen , Huang Jin-Wei , Lee Yuan-Chieh , Chang Fang-Ling , Li Ming-Hsun , Chen Nancy
Published: June 2022

Apocrine hidrocystomas are benign cystic tumors resulting from apocrine sweat glands’ proliferation. They typically present as solitary, slow-growing nodules at the head and neck, especially in the periorbital cutaneous region. We present a case of periorbital apocrine hidrocystoma in a 22-year-old woman that was treated as chalazion previously. Besides the hallmark histopathological findings of apocrine hidrocystoma, IgG4 plasma cell infiltration of the cystic wall was also found. The ratio of IgG4-to-IgG-positive plasma cells was high, whereas serum IgG4 was within the standard limit. This is, to date, the only probable IgG4-related ophthalmic disease associated with apocrine hidrocystoma.
Analysis and Suppression of Laser Intensity Fluctuation in a Dual-Beam Optical Levitation System
Authors: Wang Xia , Zhu Qi , Hu Mengzhu , Li Wenqiang , Chen Xingfan , Li Nan , Zhu Xunmin , Hu Huizhu
Published: June 2022

Levitated micro-resonators in vacuums have attracted widespread attention due to their application potential in precision force sensing, acceleration sensing, mass measurement and gravitational wave sensing. The optically levitated microsphere in a counter-propagating dual-beam optical trap has been of particular interest because of its large measurement range and flexible manipulation. In this system, laser intensity fluctuation directly influences the trap stability and measurement sensitivity, which makes it a crucial factor in improving trapping performance. In this paper, a time-varying optical force (TVOF) model is established to characterize the influence of laser intensity fluctuation in a dual-beam optical trap. The model describes the relationship between the laser intensity fluctuation, optical force and the dynamic motion of the micro-sized sphere. In addition, an external laser intensity control method is proposed, which achieved a 16.9 dB laser power stability control at the relaxation oscillation frequency. The long-term laser intensity fluctuation was suppressed from 3% to 0.4% in a one-hour period. Experiments showed that the particle’s position detection sensitivity and the stability of the relaxation oscillation could be improved by laser intensity fluctuation suppression.
Optimization of Direct Aromatic 18F-Labeling of Tetrazines
Authors: Andersen Ida Vang , García-Vázquez Rocío , Battisti Umberto Maria , Herth Matthias M.
Published: June 2022

Radiolabeling of tetrazines has gained increasing attention due to their important role in pretargeted imaging or therapy. The most commonly used radionuclide in PET imaging is fluorine-18. For this reason, we have recently developed a method which enables the direct aromatic 18F-fluorination of tetrazines using stannane precursors through copper-mediated fluorinations. Herein, we further optimized this labeling procedure. 3-(3-fluorophenyl)-1,2,4,5-tetrazine was chosen for this purpose because of its high reactivity and respective limited stability during the labeling process. By optimizing parameters such as elution conditions, precursor amount, catalyst, time or temperature, the radiochemical yield (RCY) could be increased by approximately 30%. These conditions were then applied to optimize the RCY of a recently successfully developed and promising pretargeting imaging agent. This agent could be isolated in a decay corrected RCY of 14 ± 3% and Am of 201 ± 30 GBq/µmol in a synthesis time of 70 min. Consequently, the RCY increased by 27%.
AI Technologies for Machine Supervision and Help in a Rehabilitation Scenario
Authors: Baranyi Gábor , Dos Santos Melício Bruno Carlos , Gaál Zsófia , Hajder Levente , Simonyi András , Sindely Dániel , Skaf Joul , Dušek Ondřej , Nekvinda Tomáš , Lőrincz András
Published: June 2022

We consider, evaluate, and develop methods for home rehabilitation scenarios. We show the required modules for this scenario. Due to the large number of modules, the framework falls into the category of Composite AI. Our work is based on collected videos with high-quality execution and samples of typical errors. They are augmented by sample dialogues about the exercise to be executed and the assumed errors. We study and discuss body pose estimation technology, dialogue systems of different kinds and the emerging constraints of verbal communication. We demonstrate that the optimization of the camera and the body pose allows high-precision recording and requires the following components: (1) optimization needs a 3D representation of the environment, (2) a navigation dialogue to guide the patient to the optimal pose, (3) semantic and instance maps are necessary for verbal instructions about the navigation. We put forth different communication methods, from video-based presentation to chit-chat-like dialogues through rule-based methods. We discuss the methods for different aspects of the challenges that can improve the performance of the individual components. Due to the emerging solutions, we claim that the range of applications will drastically grow in the very near future.
Association between Dietary Macronutrient Intake and Symptoms in Uninvestigated Dyspepsia: Evidence from a Population-Based, Cross-Sectional Study
Authors: Agah Shahram , Aminianfar Azadeh , Hassanzadeh Keshteli Ammar , Bitarafan Vida , Adibi Peyman , Esmaillzadeh Ahmad , Feinle-Bisset Christine
Published: June 2022

(1) Background: Limited evidence from laboratory-based studies suggests that specific dietary macronutrients, particularly fat, can induce dyspeptic symptoms. Through a population-based study, we investigated the relationship between dietary macronutrients and dyspeptic symptoms and sought to determine macronutrient intake thresholds to predict or prevent dyspepsia and reduce symptoms in patients with dyspepsia. (2) Methods: A total of 4763 Iranian people were enrolled in this population-based, cross-sectional study. Uninvestigated dyspepsia (UD) and its symptoms, including postprandial fullness, early satiation, and epigastric pain, were evaluated using a modified Persian version of the Rome III criteria. The dietary intakes of participants were evaluated using a validated food–frequency questionnaire. Receiver operating characteristic (ROC) curve analysis was used to calculate threshold intakes of dietary macronutrients to prevent UD in the general population. The analysis was then repeated in those with UD to calculate intake thresholds for reducing UD symptoms. (3) Results: Early satiation occurred in 6.3% (n = 302), postprandial fullness in 8.0% (n = 384) and epigastric pain in 7.8% (n = 371) of participants. The prevalence of UD was 15.2%. Compared with individuals without UD, those with UD had a lower intake of carbohydrates (48.2% vs. 49.1%) and a higher intake of fats (38.3% vs. 37.4%), while protein and energy intakes did not differ. Higher dietary fat and protein intakes were associated with a higher prevalence of postprandial fullness and epigastric pain, respectively. Macronutrient intakes to predict UD in the general population were <49% of energy from carbohydrates, >14.7% from protein, and >37.7% from fats. Carbohydrate, protein, and fat intakes to prevent symptoms among those with UD were calculated to be >48.2%, <14.6%, and <38.6%, respectively. (4) Conclusion: Higher carbohydrate intake and lower fat or protein intakes were associated with a lower likelihood of UD. Prospective studies carefully manipulating dietary macronutrient composition are warranted to investigate the value of dietary changes to improve symptoms in people with UD.
The Number of Fungiform Papillae, Taste Sensitivity and Smell Functions of Children Aged 11–15
Authors: Sobek Grzegorz , Jagielski Paweł
Published: June 2022

Differences in the ability to identify and perceive tastes and smells might influence food consumption and, ultimately, chronic nutrition-related conditions such as overweightness and obesity. This study aimed to investigate the associations between taste sensitivity and odour function, anthropometry, and quantity of fungiform papillae in children at age 11–15. Taste strips (4 base tastes), U-Sniff sticks (12 selected smells), and a filter paper strip impregnated with 6-n-propylthiouracil (PROP) were used. The photographic method was used to estimate the number of fungiform papillae (FP) on the tongue. The results showed that the quantity of FP was not related to anthropometry or gender. The taste test total scores were higher for girls, for whom the median score was 14 (12.0–15.0), than for boys, for whom the median score was 12 (9.0–13.0). Of the children, 13.9% had some difficulty in identifying odours. The Mann–Whitney U test showed that children who were most sensitive to bitter taste had more FP (p = 0.0001). The median score for this group (score = 4) was 34.0 (27.0–37.0). For those who had some problems with correctly assessing all bitter taste strips (score = 0–3), the median score was 24.0 (20.0–31.0). Higher numbers of FP were also observed in tasters, that is, people sensitive to PROP, than in nontasters. Only some measures of the taste function correlated with each other, but not very significantly. We concluded that there are multiple perceptual phases of taste, with no single measure able to entirely represent the sense of taste.
Nutritional Risk Factors Associated with Vasomotor Symptoms in Women Aged 40–65 Years
Authors: Tijerina Alexandra , Barrera Yamile , Solis-Pérez Elizabeth , Salas Rogelio , Jasso José L. , López Verónica , Ramírez Erik , Pastor Rosario , Tur Josep A. , Bouzas Cristina
Published: June 2022

Vasomotor symptoms (VMS) are the most common symptoms among menopausal women; these include hot flashes and night sweats, and palpitations often occur along with hot flashes. Some studies in Mexico reported that around 50% of women presented with VMS mainly in the menopausal transition. It has been proven that VMS are not only triggered by an estrogen deficiency, but also by nutritional risk factors. Evidence of an association between nutritional risk factors and VMS is limited in Mexican women. The aim of this study is to identify nutritional risk factors associated with VMS in women aged 40–65 years. This is a comparative cross-sectional study, undertaken in a retrospective way. A sample group (n = 406 women) was divided into four stages according to STRAW+10 (Stages of Reproductive Aging Workshop): late reproductive, menopausal transition, early postmenopause, and late postmenopause. Hot flashes were present mainly in the early postmenopause stage (38.1%, p ≤ 0.001). Two or more VMS were reported in 23.2% of women in the menopausal transition stage and 29.3% in the early postmenopause stage (p < 0.001). The presence of VMS was associated with different nutritional risk factors (weight, fasting glucose levels, cardiorespiratory fitness, and tobacco use) in women living in the northeast of Mexico.
Nutritional Ergogenic Aids in Combat Sports: A Systematic Review and Meta-Analysis
Authors: Vicente-Salar Néstor , Fuster-Muñoz Encarna , Martínez-Rodríguez Alejandro
Published: June 2022

Nutritional ergogenic aids (NEAs) are substances included within the group of sports supplements. Although they are widely consumed by athletes, evidence-based analysis is required to support training outcomes or competitive performance in specific disciplines. Combat sports have a predominant use of anaerobic metabolism as a source of energy, reaching peak exertion or sustained effort for very short periods of time. In this context, the use of certain NEAs could help athletes to improve their performance in those specific combat skills (i.e., the number of attacks, throws and hits; jump height; and grip strength, among others) as well as in general physical aspects (time to exhaustion [TTE], power, fatigue perception, heart rate, use of anaerobic metabolism, etc.). Medline/PubMed, Scopus and EBSCO were searched from their inception to May 2022 for randomised controlled trials (RCTs). Out of 677 articles found, 55 met the predefined inclusion criteria. Among all the studied NEAs, caffeine (5–10 mg/kg) showed strong evidence for its use in combat sports to enhance the use of glycolytic pathways for energy production during high-intensity actions due to a greater production of and tolerance to blood lactate levels. In this regard, abilities including the number of attacks, reaction time, handgrip strength, power and TTE, among others, were improved. Buffering supplements such as sodium bicarbonate, sodium citrate and beta-alanine may have a promising role in high and intermittent exertion during combat, but more studies are needed in grappling combat sports to confirm their efficacy during sustained isometric exertion. Other NEAs, including creatine, beetroot juice or glycerol, need further investigation to strengthen the evidence for performance enhancement in combat sports. Caffeine is the only NEA that has shown strong evidence for performance enhancement in combat sports.
Female Endurance Runners Have a Healthier Diet than Males—Results from the NURMI Study (Step 2)
Authors: Motevalli Mohamad , Wagner Karl-Heinz , Leitzmann Claus , Tanous Derrick , Wirnitzer Gerold , Knechtle Beat , Wirnitzer Katharina
Published: June 2022

Sex has been recognized to be an important indicator of physiological, psychological, and nutritional characteristics among endurance athletes. However, there are limited data addressing sex-based differences in dietary behaviors of distance runners. The aim of the present study is to explore the sex-specific differences in dietary intake of female and male distance runners competing at >10-km distances. From the initial number of 317 participants, 211 endurance runners (121 females and 90 males) were selected as the final sample after a multi-level data clearance. Participants were classified to race distance (10-km, half-marathon, marathon/ultra-marathon) and type of diet (omnivorous, vegetarian, vegan) subgroups. An online survey was conducted to collect data on sociodemographic information and dietary intake (using a comprehensive food frequency questionnaire with 53 food groups categorized in 14 basic and three umbrella food clusters). Compared to male runners, female runners had a significantly greater intake in four food clusters, including “beans and seeds”, “fruit and vegetables”, “dairy alternatives”, and “water”. Males reported higher intakes of seven food clusters, including “meat”, “fish”, “eggs”, “oils”, “grains”, “alcohol”, and “processed foods”. Generally, it can be suggested that female runners have a tendency to consume healthier foods than males. The predominance of females with healthy dietary behavior can be potentially linked to the well-known differences between females and males in health attitudes and lifestyle patterns.
Drug D, a Diosgenin Derive, Inhibits L-Arginine-Induced Acute Pancreatitis through Meditating GSDMD in the Endoplasmic Reticulum via the TXNIP/HIF-1α Pathway
Authors: Zhang Cuicui , Niu Hai , Wan Chengyu , Yu Xiuxian , Xin Guang , Zhu Yuda , Wei Zeliang , Li Fan , Wang Yilan , Zhang Kun , Li Shiyi , Dong Yuman , Li Yangying , Huang Wen
Published: June 2022

Acute pancreatitis (AP) is one of the most common causes of hospitalization for gastrointestinal diseases, with high morbidity and mortality. Endoplasmic reticulum stress (ERS) and Gasdermin D (GSDMD) mediate AP, but little is known about their mutual influence on AP. Diosgenin has excellent anti-inflammatory and antioxidant effects. This study investigated whether Diosgenin derivative D (Drug D) inhibits L-arginine-induced acute pancreatitis through meditating GSDMD in the endoplasmic reticulum (ER). Our studies were conducted in a mouse model of L-arginine-induced AP as well as in an in vitro model on mouse pancreatic acinar cells. The GSDMD accumulation in ER was found in this study, which caused ERS of acinar cells. GSDMD inhibitor Disulfiram (DSF) notably decreased the expression of GSDMD in ER and TXNIP/HIF-1α signaling. The molecular docking study indicated that there was a potential interaction between Drug D and GSDMD. Our results showed that Drug D significantly inhibited necrosis of acinar cells dose-dependently, and we also found that Drug D alleviated pancreatic necrosis and systemic inflammation by inhibiting the GSDMD accumulation in the ER of acinar cells via the TXNIP/HIF-1α pathway. Furthermore, the level of p-IRE1α (a marker of ERS) was also down-regulated by Drug D in a dose-dependent manner in AP. We also found that Drug D alleviated TXNIP up-regulation and oxidative stress in AP. Moreover, our results revealed that GSDMD-/- mitigated AP by inhibiting TXNIP/HIF-1α. Therefore, Drug D, which is extracted from Dioscorea zingiberensis, may inhibit L-arginine-induced AP by meditating GSDMD in the ER by the TXNIP /HIF-1α pathway.
The Controversial Role of Vitamin D in Thyroid Cancer Prevention
Authors: Palanca Ana , Ampudia-Blasco Francisco Javier , Real José T.
Published: June 2022

Thyroid cancer is the most common endocrine malignancy and exhibits rising incidence. Annual incidence varies by sex, age, and geographical location. It has been reported that impairment of vitamin D signalling promotes thyroid cancer progression. Recent studies have shown that vitamin D, a fat-soluble vitamin that acts as both a nutrient and a hormone, may have utility in the prevention of autoimmune thyroid-related diseases. However, the precise role of vitamin D in the pathobiology of thyroid cancer is controversial. Previous studies have suggested that elevated serum vitamin D levels have a protective role in thyroid cancer. However, there is also evidence demonstrating no inverse relationship between vitamin D levels and the occurrence of thyroid cancer. Furthermore, recent data provide evidence that circulating vitamin D concentration is inversely correlated with disease aggressiveness and poor prognosis, while evidence of an association with tumour initiation remains weak. Nevertheless, a variety of data support an anti-tumorigenic role of vitamin D and its potential utility as a secondary chemopreventive agent. In this review, we highlighted recent findings regarding the association of vitamin D status with the risk of thyroid cancer, prognosis, potential mechanisms, and possible utility as a chemopreventive agent.
Regioselective Transfer Hydrogenative Defluorination of Polyfluoroarenes Catalyzed by Bifunctional Azairidacycle
Authors: Matsunami Asuka , Kuwata Shigeki , Kayaki Yoshihito
Published: June 2022

The catalytic hydrodefluorination (HDF) with a bifunctional azairidacycle using HCOOK was examined for cyano- and chloro-substituted fluoroarenes, including penta- and tetrafluorobenzonitriles, tetrafluoroterephthalonitrile, tetrafluorophthalonitrile, 3-chloro-2,4,5,6-tetrafluoropyridine, and 4-cyano-2,3,5,6-tetrafluoropyridine. The reaction was performed in the presence of a controlled amount of HCOOK with a substrate/catalyst ratio (S/C) of 100 in a 1:1 mixture of 1,2-dimethoxyethane (DME) and H2O at an ambient temperature of 30 °C to obtain partially fluorinated compounds with satisfactory regioselectivities. The C–F bond cleavage proceeded favorably at the para position of substituents other than fluorine, which is in consonance with the nucleophilic aromatic substitution mechanism. In the HDF of tetrafluoroterephthalonitrile and 4-cyano-2,3,5,6-tetrafluoropyridine, which do not contain a fluorine atom at the para position of the cyano group, the double defluorination occurred solely at the 2- and 5-positions, as confirmed by X-ray crystallography. The HDF of 3-chloro-2,4,5,6-tetrafluoropyridine gave preference to the C–F bond cleavage over the C–Cl bond cleavage, unlike the dehalogenation pathway via electron-transfer radical anion fragmentation. In addition, new azairidacycles with an electron-donating methoxy substituent on the C–N chelating ligand were synthesized and served as a catalyst precursor (0.2 mol%) for the transfer hydrogenative defluorination of pentafluoropyridine, leading to 2,3,5,6-tetrafluoropyridine with up to a turnover number (TON) of 418.
Design and Synthesis of Hepatitis B Virus (HBV) Capsid Assembly Modulators and Evaluation of Their Activity in Mammalian Cell Model
Authors: Spunde Karina , Vigante Brigita , Dubova Unda Nelda , Sipola Anda , Timofejeva Irena , Zajakina Anna , Jansons Juris , Plotniece Aiva , Pajuste Karlis , Sobolev Arkadij , Muhamadejev Ruslan , Jaudzems Kristaps , Duburs Gunars , Kozlovska Tatjana
Published: June 2022

Capsid assembly modulators (CAMs) have emerged as a promising class of antiviral agents. We studied the effects of twenty-one newly designed and synthesized CAMs including heteroaryldihydropyrimidine compounds (HAPs), their analogs and standard compounds on hepatitis B virus (HBV) capsid assembly. Cytoplasmic expression of the HBV core (HBc) gene driven by the exogenously delivered recombinant alphavirus RNA replicon was used for high level production of the full-length HBc protein in mammalian cells. HBV capsid assembly was assessed by native agarose gel immunoblot analysis, electron microscopy and inhibition of virion secretion in HepG2.2.15 HBV producing cell line. Induced fit docking simulation was applied for modelling the structural relationships of the synthesized compounds and HBc. The most efficient were the HAP class compounds—dihydropyrimidine 5-carboxylic acid n-alkoxyalkyl esters, which induced the formation of incorrectly assembled capsid products and their accumulation within the cells. HBc product accumulation in the cells was not detected with the reference HAP compound Bay 41-4109, suggesting different modes of action. A significant antiviral effect and substantially reduced toxicity were revealed for two of the synthesized compounds. Two new HAP compounds revealed a significant antiviral effect and a favorable toxicity profile that allows these compounds to be considered promising leads and drug candidates for the treatment of HBV infection. The established alphavirus based HBc expression approach allows for the specific selection of capsid assembly modulators directly in the natural cell environment.
New Membrane Active Antibacterial and Antiviral Amphiphiles Derived from Heterocyclic Backbone of Pyridinium-4-Aldoxime
Authors: Crnčević Doris , Krce Lucija , Cvitković Mislav , Brkljača Zlatko , Sabljić Antonio , Vuko Elma , Primožič Ines , Odžak Renata , Šprung Matilda
Published: June 2022

Quaternary ammonium salts (QAS) are irreplaceable membrane-active antimicrobial agents that have been widely used for nearly a century. Cetylpyridinium chloride (CPC) is one of the most potent QAS. However, recent data from the literature indicate that CPC activity against resistant bacterial strains is decreasing. The major QAS resistance pathway involves the QacR dimer, which regulates efflux pump expression. A plausible approach to address this issue is to structurally modify the CPC structure by adding other biologically active functional groups. Here, a series of QAS based on pyridine-4-aldoxime were synthesized, characterized, and tested for antimicrobial activity in vitro. Although we obtained several potent antiviral candidates, these candidates had lower antibacterial activity than CPC and were not toxic to human cell lines. We found that the addition of an oxime group to the pyridine backbone resulted in derivatives with large topological polar surfaces and with unfavorable cLog P values. Investigation of the antibacterial mode of action, involving the cell membrane, revealed altered cell morphologies in terms of corrugated and/or disrupted surface, while 87% of the cells studied exhibited a permeabilized membrane after 3 h of treatment at 4 × minimum inhibitory concentration (MIC). Molecular dynamic (MD) simulations of the interaction of QacR with a representative candidate showed rapid dimer disruption, whereas this was not observed for QacR and QacR bound to the structural analog CPC. This might explain the lower bioactivity of our compounds, as they are likely to cause premature expression of efflux pumps and thus activation of resistance.
Therapeutic Efficacy of Arnica in Hamsters with Cutaneous Leishmaniasis Caused by Leishmania braziliensis and L. tropica
Authors: Robledo Sara M. , Murillo Javier , Arbeláez Natalia , Montoya Andrés , Ospina Victoria , Jürgens Franziska M. , Vélez Iván D. , Schmidt Thomas J.
Published: June 2022

Leishmaniasis may occur in three different clinical forms, namely, visceral, mucocutaneous and cutaneous, which are caused by different species of trypanosomatid protozoans of the genus Leishmania. Pentavalent antimonials are the leading treatment for cutaneous leishmaniasis despite the hepatic, renal, and cardiac toxicity. In addition, the response of some Leishmania species to pentavalent antimonials is increasingly poorer, and therefore new and more potent therapeutic alternatives are needed. Arnica montana L., Asteraceae, is a traditional medicinal plant of Europe and preparations of its flowers are commonly used externally to treat disorders of the musculoskeletal system as well as superficial inflammatory conditions. Previous studies have shown that Arnica tincture (AT), an ethanolic extract prepared from the flowerheads of Arnica montana as well as isolated Arnica sesquiterpene lactones (STLs) have antileishmanial activity in vitro against L. donovani and L. infantum, as well as in vivo against L. braziliensis. In this work, we studied the in vitro cytotoxicity and antileishmanial activity of AT and STLs against both L. braziliensis and L. tropica. The in vivo therapeutic effect of AT was studied in hamsters with cutaneous Leishmaniasis (CL) caused by experimental infection with L. braziliensis and L. tropica. Furthermore, various semisolid Arnica preparations were also evaluated against L. braziliensis. The STLs and the AT possess a very high in vitro activity against both Leishmania species with median effective concentrations (EC50) ranging from 1.9 to 5.9 μg/mL. The AT was not cytotoxic for human tissue macrophages, skin fibroblasts, and hepatic cells. The therapeutic response of hamsters infected with L. braziliensis to the topical treatment with AT was 87.5% at a dose of 19.2 μg STL/2× day/60 d, 72.7% at doses of 19.2 μg STL/1× d/60 d and 67% at a dose of 38.4 μg STL/2× d/60 d. In turn, the therapeutic response in hamsters infected with L. tropica was 100% when treated at a dose of 19.2 μg STL/2× day/60 d and 71% at a dose of 38.4 μg STL/2× d/60 d. On the other hand, the effectiveness of treatment with glucantime administered intralesionally at a dose of 200 mg/every three days for 30 days was 62.5% for L. braziliensis and 37.5% for L. tropica infection. These results are promising and encourage the implementation of clinical trials with AT in CL patients as a first step to using AT as a drug against CL.
Development of (4-Phenylamino)quinazoline Alkylthiourea Derivatives as Novel NF-κB Inhibitors
Authors: Darwish Sarah S. , Chen Po-Jen , Hamed Mostafa M. , Wagdy Reem A. , Chen Shun-Hua , Abadi Ashraf H. , Abdel-Halim Mohammad , Hwang Tsong-Long , Engel Matthias
Published: June 2022

For many inflammatory diseases, new effective drugs with fewer side effects are needed. While it appears promising to target the activation of the central pro-inflammatory transcription factor NF-κB, many previously discovered agents suffered from cytotoxicity. In this study, new alkylthiourea quinazoline derivatives were developed that selectively inhibit the activation of NF-κB in macrophage-like THP−1 cells while showing low general cytotoxicity. One of the best compounds, 19, strongly inhibited the production of IL-6 (IC50 = 0.84 µM) and, less potently, of TNFα (IC50 = 4.0 µM); in comparison, the reference compound, caffeic acid phenethyl ester (CAPE), showed IC50s of 1.1 and 11.4 µM, respectively. Interestingly, 19 was found to block the translocation of the NF-κB dimer to the nucleus, although its release from the IκB complex was unaffected. Furthermore, 19 suppressed the phosphorylation of NF-κB-p65 at Ser468 but not at Ser536; however, 19 did not inhibit any kinase involved in NF-κB activation. The only partial suppression of p65 phosphorylation might be associated with fewer side effects. Since several compounds selectively induced cell death in activated macrophage-like THP−1 cells, they might be particularly effective in various inflammatory diseases that are exacerbated by excess activated macrophages, such as arteriosclerosis and autoimmune diseases.
Quaternized Chitosan Thiol Hydrogel-Thickened Nanoemulsion: A Multifunctional Platform for Upgrading the Topical Applications of Virgin Olive Oil
Authors: Nasr Ali M. , Aboelenin Salama M. , Alfaifi Mohammad Y. , Shati Ali A. , Elbehairi Serag Eldin I. , Elshaarawy Reda F. M. , Elwahab Nashwa H. Abd
Published: June 2022

(1) Background: Virgin olive oil (VOO) has attracted the attention of many researchers due to its nutritional and medicinal values. However, VOO’s biological applications have been limited due to a lack of precise chemical profiling and approach to increase the physicochemical characteristics, bioactivity, and delivery of its bioactive components; (2) Methods: The current study intended to evaluate the chemical composition of VOO using the GC-MS technique and determine its major components. Furthermore, the effect of incorporating VOO into Tween 80-lecithin nanoemulsion (OONE) and a quaternized trimethyl chitosan-thiol (TMCT) hydrogel-thickened nanoemulsion system (OOHTN) on its physicochemical characteristics and biological potentials will be investigated; (3) Results: The VOO-based NEs’ physicochemical properties (particle size and zeta potential) were steady during storage for four weeks owing to the inclusion of the protective TMCT hydrogel network to OONE. Excessive fine-tuning of olive oil nanoemulsion (OONE) and the TMCT protective network’s persistent positive charge have contributed to the oil’s improved antimicrobial, anti-biofilm, and antioxidant potentials; (4) Conclusions: The Tween 80-lecithin-TMCT nanosystem might provide a unique and multifunctional nanoplatform for efficient topical therapy as well as the transdermal delivery of lipophilic bioactive compounds.
Co-Functionalization of Gold Nanoparticles with C7H2 and HuAL1 Peptides: Enhanced Antimicrobial and Antitumoral Activities
Authors: Formaggio Daniela M. D. , Magalhães Jéssica A. , Andrade Vitor M. , Conceição Katia , Anastácio Juliana M. , Santiago Gabrielli S. , Arruda Denise C. , Tada Dayane B.
Published: June 2022

The functionalization of nanoparticles with therapeutic peptides has been pointed out as a promising strategy to improve the applications of these molecules in the field of health sciences. Peptides are highly bioactive but face several limitations such as low bioavailability due to the difficulty of overcoming the physiological barriers in the body and their degradation by enzymes. In this work, gold nanoparticles (AuNPs) were co-functionalized with two therapeutic peptides simultaneously. The peptides from the complementary determining region of monoclonal antibodies, composed of the amino acid sequences YISCYNGATSYNQKFK (C7H2) and RASQSVSSYLA (HuAL1) were chosen for having exhibited antitumor and antimicrobial activity before. The peptides-conjugated AuNPs were characterized regarding size, morphology, and metal concentration by using TEM, dynamic light scattering, and ICP-OES techniques. Then, peptides-conjugated AuNPs were evaluated regarding the antimicrobial activity against E. coli, P. aeruginosa, and C. albicans. The antitumoral activity was evaluated in vitro by cell viability assays with metastatic melanoma cell line (B16F10-Nex2) and the cytotoxicity was evaluated against human foreskin fibroblast (Hs68) cell line. Finally, in vivo assays were performed by using a syngeneic animal model of metastatic melanoma. Our findings have highlighted the potential application of the dual-peptide AuNPs in order to enhance the antitumor and antimicrobial activity of peptides.
UPS, XPS, NEXAFS and Computational Investigation of Acrylamide Monomer
Authors: Evangelisti Luca , Melandri Sonia , Negri Fabrizia , Coreno Marcello , Prince Kevin C. , Maris Assimo
Published: June 2022

Acrylamide is a small conjugated organic compound widely used in industrial processes and agriculture, generally in the form of a polymer. It can also be formed from food and tobacco as a result of Maillard reaction from reducing sugars and asparagine during heat treatment. Due to its toxicity and possible carcinogenicity, there is a risk in its release into the environment or human intake. In order to provide molecular and energetic information, we use synchrotron radiation to record the UV and X-ray photoelectron and photoabsorption spectra of acrylamide. The data are rationalized with the support of density functional theory and ab initio calculations, providing precise assignment of the observed features.
Parametric Excitation of Ultracold Sodium Atoms in an Optical Dipole Trap
Authors: Zheng Ningxuan , Liu Wenliang , Wu Jizhou , Li Yuqing , Sovkov Vladimir , Ma Jie
Published: June 2022

Parametric modulation is an effective tool to measure the trap frequency and investigate the atom dynamics in an optical dipole trap or lattices. Herein, we report on experimental research of parametric resonances in an optical dipole trap. By modulating the trapping potential, we have measured the atomic loss dependence on the frequency of the parametric modulations. The resonance loss spectra and the evolution of atom populations at the resonant frequency have been demonstrated and compared under three modulation waveforms (sine, triangle and square waves). A phenomenological theoretical simulation has been performed and shown good accordance with the observed resonance loss spectra and the evolution of atom populations. The theoretical analysis can be easily extended to a complex waveform modulation and reproduce enough of the experiments.
Experimental and In-Silico Computational Modeling of Cerium Oxide Nanoparticles Functionalized by Gelatin as an Eco-Friendly Anti-Corrosion Barrier on X60 Steel Alloys in Acidic Environments
Authors: El-Lateef Hany M. Abd , Gouda Mohamed , Khalaf Mai M. , Al-Shuaibi Manal A. A. , Mohamed Ibrahim M. A. , Shalabi Kamal , El-Shishtawy Reda M.
Published: June 2022

An eco-friendly and a facile route successfully prepared novel cerium oxide nanoparticles functionalized by gelatin. The introduced CeO2@gelatin was investigated in terms of FE-SEM, EDX, TEM, chemical mapping, FT-IR, and (TGA) thermal analyses. These characterization tools indicate the successful synthesis of a material having CeO2 and gelatin as a composite material. The prepared composite CeO2@gelatin was used as an environment-friendly coated film or X60 steel alloys in acidizing oil well medium. Moreover, the effect of CeO2 percent on film composition was investigated. LPR corrosion rate, Eocp-time, EIS, and PDP tools determined the corrosion protection capacity. The CeO2@gelatin composite exhibited high protection capacity compared to pure gelatin; in particular, 5.0% CeO2@gelatin coating film shows the highest protection capacity (98.2%), with long-term anti-corrosive features. The % CeO2@gelatin-coated films formed the protective adsorbed layer on the steel interface by developing a strong bond among nitrogen atoms in the CeO2@gelatin film and the electrode interface. Surface morphology using FESEM measurements confirmed the high efficiency of the fabricated CeO2@gelatin composite on the protection X60 steel alloys. DFT calculations and MC simulations were explored to study the relations between the protection action and the molecular construction of the coated systems, which were in good alignment with the empirical findings.
Gagaku in Medieval Japanese Religion
Authors: Rambelli Fabio
Published: June 2022

Contrary to the widespread assumption in the study of Japanese religions that Kagura is historically the main genre of performing arts at Shintō festivals, something dating back to the beginning of Japanese history, in this article I focus instead on Gagaku (and its Bugaku dance repertory) as a central component of rituals, ceremonies, and festivals not only at the imperial court but also and especially at many temples and shrines across the country. While Gagaku and Bugaku were deeply rooted in the Kansai area, with guilds of hereditary professional musicians affiliated with, respectively, the imperial court in Kyoto, Kasuga-Kōfukuji in Nara, and Shitennōji in Osaka, and with the most lavish performances being held at temples and shrines in the region, those art forms had already spread to the provinces by the end of the Heian period. This article investigates some of the connections between religious ideas, rituals, and musical performances in relation to Kuroda Toshio’s concept of the exo-esoteric system (kenmitsu taisei) and the creative use of Buddhist canonical sources that such connections originated.
Segmentation of PMSE Data Using Random Forests
Authors: Jozwicki Dorota , Sharma Puneet , Mann Ingrid , Hoppe Ulf-Peter
Published: June 2022

EISCAT VHF radar data are used for observing, monitoring, and understanding Earth’s upper atmosphere. This paper presents an approach to segment Polar Mesospheric Summer Echoes (PMSE) from datasets obtained from EISCAT VHF radar data. The data consist of 30 observations days, corresponding to 56,250 data samples. We manually labeled the data into three different categories: PMSE, Ionospheric background, and Background noise. For segmentation, we employed random forests on a set of simple features. These features include: altitude derivative, time derivative, mean, median, standard deviation, minimum, and maximum values corresponding to neighborhood sizes ranging from 3 by 3 to 11 by 11 pixels. Next, in order to reduce the model bias and variance, we employed a method that decreases the weight applied to pixel labels with large uncertainty. Our results indicate that, first, it is possible to segment PMSE from the data using random forests. Second, the weighted-down labels technique improves the performance of the random forests method.
Training a Disaster Victim Detection Network for UAV Search and Rescue Using Harmonious Composite Images
Authors: Zhang Ning , Nex Francesco , Vosselman George , Kerle Norman
Published: June 2022

Human detection in images using deep learning has been a popular research topic in recent years and has achieved remarkable performance. Training a human detection network is useful for first responders to search for trapped victims in debris after a disaster. In this paper, we focus on the detection of such victims using deep learning, and we find that state-of-the-art detection models pre-trained on the well-known COCO dataset fail to detect victims. This is because all the people in the training set are shown in photos of daily life or sports activities, while people in the debris after a disaster usually only have parts of their bodies exposed. In addition, because of the dust, the colors of their clothes or body parts are similar to those of the surrounding debris. Compared with collecting images of common objects, images of disaster victims are extremely difficult to obtain for training. Therefore, we propose a framework to generate harmonious composite images for training. We first paste body parts onto a debris background to generate composite victim images and then use a deep harmonization network to make the composite images look more harmonious. We select YOLOv5l as the most suitable model, and experiments show that using composite images for training improves the AP (average precision) by 19.4% (15.3%→34.7%). Furthermore, using the harmonious images is of great benefit to training a better victim detector, and the AP is further improved by 10.2% (34.7%→44.9%). This research is part of the EU project INGENIOUS. Our composite images and code are publicly available on our website.
Evaluation of Atmospheric Correction Algorithms over Lakes for High-Resolution Multispectral Imagery: Implications of Adjacency Effect
Authors: Pan Yanqun , Bélanger Simon , Huot Yannick
Published: June 2022

Atmospheric correction of satellite optical imagery over inland waters is a key remaining challenge in aquatic remote sensing. This is due to numerous confounding factors such as the complexity of water optical properties, the surface glint, the heterogeneous nature of atmospheric aerosols, and the proximity of bright land surfaces. This combination of factors makes it difficult to retrieve accurate information about the system observed. Moreover, the impact of radiance coming from adjacent land (adjacency effects) in complex geometries further adds to this challenge, especially for small lakes. In this study, ten atmospheric correction algorithms were evaluated for high-resolution multispectral imagery of Landsat-8 Operational Land Imager and Sentinel-2 MultiSpectral Instrument using in situ optical measurements from ~300 lakes across Canada. The results of the validation show that the performance of the algorithms varies by spectral band and evaluation metrics. The dark spectrum fitting algorithm had the best performance in terms of similarity angle (spectral shape), while the neural network-based models showed the lowest errors and bias per band. However, none of the tested atmospheric correction algorithms meet a 30% retrieval accuracy target across all the visible bands, likely due to uncorrected adjacency effects. To quantify this process, three-dimensional radiative transfer simulations were performed and compared to satellite observations. These simulations show that up to 60% of the top of atmosphere reflectance in the near-infrared bands over the lake was from the adjacent lands covered with green vegetation. The significance of these adjacency effects on atmospheric correction has been analyzed qualitatively, and potential efforts to improve the atmospheric correction algorithms are discussed.
Spatiotemporal Characteristics and Heterogeneity of Vegetation Phenology in the Yangtze River Delta
Authors: Yang Cancan , Deng Kai , Peng Daoli , Jiang Ling , Zhao Mingwei , Liu Jinbao , Qiu Xincai
Published: June 2022

Vegetation phenology and its spatiotemporal driving factors are essential to reflect global climate change, the surface carbon cycle and regional ecology, and further quantitative studies on spatiotemporal heterogeneity and its two-way driving are needed. Based on MODIS phenology, meteorology, land cover and other data from 2001 to 2019, this paper analyzes the phenology change characteristics of the Yangtze River Delta from three dimensions: time, plane space and elevation. Then, the spatiotemporal heterogeneity of phenology and its driving factors are explored with random forest and geographic detector methods. The results show that (1) the advance of start of season (SOS) is insignificant—with 0.17 days per year; the end of season (EOS) shows a significant delay—0.48 days per year. The preseason temperature has a greater contribution to SOS, while preseason precipitation is main factor in determining EOS. (2) Spatial differences of the phenological index do not strictly obey the change rules of latitude at a provincial scale. The SOS of Jiangsu and Anhui is earlier than that of Zhejiang and Shanghai, and EOS shows an obvious double-clustering phenomenon. In addition, a divergent response of EOS with elevation grades is found; the most significant changes are observed at grades below 100 m. (3) Land cover (LC) type is a major factor of the spatial heterogeneity of phenology, and its change may also be one of the insignificant factors driving the interannual change of phenology. Furthermore, nighttime land surface temperature (NLST) has a relatively larger contribution to the spatial heterogeneity in non-core urban areas, but population density (PD) contributes little. These findings could provide a new perspective on phenology and its complex interactions between natural or anthropogenic factors.