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Potential Health Risks of Chloroacetanilide Herbicides: An In Silico Analysis 氯乙酰苯胺类除草剂的潜在健康风险:硅分析
Pub Date : 2023-05-15 DOI: 10.16984/saufenbilder.1281720
A. A. Berber, Şefika Nur Demi̇r, Nihan AKINCI KENANOĞLU
The extensive use of herbicidal products in agriculture and forestry has raised concerns over potential adverse effects on human health and the environment. Chloroacetanilide herbicides are a group of synthetic chemicals used to control weeds in agriculture and forestry. However, so[me of their members have been characterized as possible carcinogens. The genotoxicity and carcinogenicity of two chloroacetanilide herbicides, delachlor and xylachlor, are discussed. This article proposes to use tools to predict their potential toxicities based on their chemical structure. Four software tools, Vega Hub, Toxtree, Lazar, and TEST, are used to predict the potential genotoxic and carcinogenic effects of the herbicides. Vega Hub uses QSAR models, Toxtree uses a decision tree approach, Lazar uses data mining algorithms, and TEST uses QSAR methods to estimate toxicity. The canonical Simplified Molecular Input Line Entry Specification (SMILES) systems of delachlor and xylachlor are entered into each software tool to create a prediction. The study found that delachlor and xylachlor is a class 3 highly toxic compounds with potential mutagenic and carcinogenic effects based on Toxtree and Vega Hub. Meanwhile, Lazar and TEST predicted that delachlor and xylachlor are unlikely to be mutagenic. This study to determine the toxicity of the herbicides delachlor and xylachlor has shown that the possible effects of these herbicides on health and the environment need to be further investigated. The results provide valuable insights into chloroacetanilide herbicide toxicity and help develop safer, more environmentally friendly alternatives.
除草产品在农业和林业中的广泛使用已引起人们对其对人类健康和环境的潜在不利影响的关注。氯乙酰苯胺除草剂是一组用于控制农业和林业杂草的合成化学品。然而,他们的一些成员被认为是可能的致癌物。讨论了二氯草胺和木氯草胺两种氯乙醯胺类除草剂的遗传毒性和致癌性。本文提出利用工具根据其化学结构预测其潜在毒性。Vega Hub、Toxtree、Lazar和TEST这四个软件工具被用来预测除草剂潜在的基因毒性和致癌作用。Vega Hub使用QSAR模型,Toxtree使用决策树方法,Lazar使用数据挖掘算法,TEST使用QSAR方法来估计毒性。在每个软件工具中输入二氯草胺和木氯草胺的规范简化分子输入线输入规范(SMILES)系统来创建预测。基于Toxtree和Vega Hub的研究发现,delachlor和xyylachlor是3类剧毒化合物,具有潜在的致突变和致癌作用。同时,Lazar和TEST预测,delachlor和xyylachlor不太可能具有诱变性。这项确定除草剂二氯草胺和木氯草胺毒性的研究表明,这些除草剂对健康和环境的可能影响需要进一步调查。研究结果为氯乙酰苯胺除草剂的毒性提供了有价值的见解,并有助于开发更安全、更环保的替代品。
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引用次数: 0
Radon Gas Estimation from Building Materials 建筑材料氡气的估算
Pub Date : 2023-05-12 DOI: 10.16984/saufenbilder.1266590
Safa Başdemi̇r, Caner Yalcin
Radon gas originating from building materials is generally thought to cause low concentration. Investigation and estimation of radon levels originating from building materials are important in terms of public health due to the use of dense concrete in tunnel form type houses, which is a building type widely used in Turkey, even though a significant part of Turkey is an earthquake zone. In this article, the effects of different parameters such as 238U concentration in building materials, diffusion constant of building elements, emanation rate, and ventilation rate on radon gas concentration are investigated. As a result, it is concluded that in some cases (such as high diffusion coefficient and insufficient ventilation rate) in houses built with tunnel form concrete structures, the radon level arising from building materials can reach a level that cannot be neglected.
来自建筑材料的氡气通常被认为是低浓度的。对建筑材料产生的氡水平进行调查和估计对公共卫生很重要,因为隧道式房屋使用密集混凝土,这是土耳其广泛使用的一种建筑类型,尽管土耳其的很大一部分地区是地震带。本文研究了建筑材料中238U浓度、建筑元素扩散常数、辐射速率、通风量等不同参数对氡气浓度的影响。因此,在某些情况下(如扩散系数高和通风率不足),隧道形式混凝土结构的房屋中,建筑材料产生的氡水平可以达到不可忽视的水平。
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引用次数: 0
Development of Cordierite Based Carrier Refractory Sagar Bodies for Bone Porcelain Firing Process 骨瓷烧制用堇青石基载体耐火Sagar体的研制
Pub Date : 2023-05-03 DOI: 10.16984/saufenbilder.1260673
Murat Ispalarli, Zuhal Karaağaç
During the firing process of porcelain tableware; Biscuit firing takes place at low temperatures (980-1000°C), while glazed firing takes place at high temperatures (1250-1280°C for soft porcelain, 1350-1380°C for hard porcelain). Biscuit firing in bone porcelain products, which is in the soft porcelain class, is done at higher temperatures than glazed firings. Due to the presence of bone ash in the Bone China recipe formulation, it causes the bodies to undergo vitrification in a narrow range and thus the final product to deform during sintering. Bone porcelain products are fired on carrier refractories called sagar so that they do not deform during sintering. Sagars are designed to support that model for each product model and do not shrink or deform during firing thanks to its low thermal expansion coefficient. In this study, a refractory body with a porous structure with the code of "PS1-Std" was developed by performing the characterization analyzes of refractory products with different technical properties supplied from different companies. In order to improve the mechanical properties by changing the ratios of talc, alumina, quartz and zircon in the recipe composition; A refractory product containing 8.47% zircon in its recipe composition and containing indialite, corundum, mullite, quartz and zircon phases after sintering has been developed. The microstructure images of the developed refractory product were examined with the support of SEM analysis. It has been observed that refractory products obtained as a result of recipe development studies offer a 10% longer service life than equivalent refractory products.
陶瓷餐具在烧制过程中;饼干烧制在低温下进行(980-1000°C),而釉面烧制在高温下进行(软瓷1250-1280°C,硬瓷1350-1380°C)。骨瓷产品的饼干烧制属于软瓷类,比釉面烧制的温度更高。由于骨瓷配方配方中存在骨灰,它会导致瓷体在很小的范围内发生玻璃化,从而导致最终产品在烧结过程中变形。骨瓷制品是在称为sagar的载体耐火材料上烧制的,因此它们在烧结过程中不会变形。Sagars设计用于支持每种产品型号的模型,并且由于其热膨胀系数低,在点火过程中不会收缩或变形。在本研究中,通过对不同公司提供的不同技术性能的耐火材料进行表征分析,开发了一个具有多孔结构的耐火材料体,代码为“PS1-Std”。通过改变配方组成中滑石、氧化铝、石英和锆石的比例来改善其力学性能;研制出配方成分中锆石含量为8.47%,烧结后含有独长石、刚玉、莫来石、石英和锆石相的耐火产品。利用扫描电镜对所研制的耐火材料的微观结构进行了分析。据观察,由于配方开发研究而获得的耐火材料产品比同等耐火材料产品的使用寿命长10%。
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引用次数: 0
An Ethnobotanical Study on Plants Used in the Treatment of Gynecological Diseases in Some Provinces of the Eastern Anatolia Region 东安纳托利亚地区部分省份妇科治疗用植物的民族植物学研究
Pub Date : 2023-05-02 DOI: 10.16984/saufenbilder.1241517
S. Karakaya, Zehra Kimişoğlu, Ü. Incekara, Ö. Aksakal, Yusuf Ziya Sümbüllü, Ahmet Polat
This work was supported by “The Republic of Turkey Ministry of Agriculture and Forestry General Directorate of Nature Conservation and National Parks.” It was carried out to document the plants used by people living in and around Ardahan, Iğdır and Kars provinces between 2020-2021 for gynecological diseases. For this purpose, medicinal plants used by the public for therapeutic purposes were collected and determined, their use, and parts used were reported, and herbarium samples were prepared. Regular visits were arranged to the regions where the research was carried out, and surveys were conducted by interviewing and speaking with the area's people. It was determined that 34 medicinal plant taxa belonging to 18 plant families were used in gynecological diseases among the people of Ardahan, Iğdır and Kars provinces and their surroundings. These plants include 26 wild species and 7 cultivated species. It has been observed that the most commonly used medicina plant families in gynecological diseases are Asteraceae (6), Malvaceae (5) and Lamiaceae (3). Although traditional medicine is widely practiced in the regions where it is studied, it is rapidly being replaced by modern medicine and pharmacy.
这项工作得到了“土耳其共和国农业和林业部自然保护和国家公园总局”的支持。该研究旨在记录2020年至2021年期间阿尔达汉、Iğdır和卡尔斯省及其周边地区居民用于妇科疾病的植物。为此,收集和确定了公众用于治疗目的的药用植物,报告了它们的用途和使用部位,并制作了植物标本室样本。定期访问进行研究的地区,并通过采访和与该地区的人们交谈进行调查。结果表明,在阿尔达汉、Iğdır和卡尔斯省及其周边地区,34个药用植物类群隶属于18个植物科,用于治疗妇科疾病。其中野生植物26种,栽培植物7种。据观察,妇科疾病最常用的药用植物科是Asteraceae(6)、Malvaceae(5)和Lamiaceae(3)。尽管传统医学在其研究地区广泛应用,但它正在迅速被现代医学和药学所取代。
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引用次数: 0
The Effects of Route Optimization Software to the Customer Satisfaction 路线优化软件对顾客满意度的影响
Pub Date : 2023-05-02 DOI: 10.16984/saufenbilder.1259595
Ali Durdu, Muhammed Faik Kaya
Route optimization, which is a result of the advancement of technology today, makes companies profitable within months. The aim of this study is to explain the relation between route optimization software and the customer satisfaction. Route optimization softwares become widely used by the companies and this study touches briefly on the subject of the relation between route optimization software and customer satisfaction level. While explain this relation, the study described route optimization software, how it works and its execution areas. Hereafter, the article start to explain customer satisfaction and route optimization software’s effects on customer satisfaction and conclude the study. In the drafting and writing process of this article, the topic is detaily searched and analyzed.
路线优化是当今技术进步的结果,可以使公司在几个月内实现盈利。本研究的目的是解释路线优化软件与顾客满意度之间的关系。路线优化软件在企业中得到了广泛的应用,本研究对路线优化软件与顾客满意度之间的关系进行了简要的探讨。在解释这种关系的同时,本研究描述了路线优化软件,它是如何工作的以及它的执行区域。接下来,文章开始解释顾客满意度和路线优化软件对顾客满意度的影响,并对研究进行总结。在本文的起草和写作过程中,对该主题进行了详细的搜索和分析。
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引用次数: 0
Kodlayıcı Hurwitz Tamsayıları: Küçük Kalanlı Bölme Özelliğine Sahip Hurwitz Tamsayıları
Pub Date : 2023-04-26 DOI: 10.16984/saufenbilder.1248060
Ramazan Duran
Considering error-correcting codes over Hurwitz integers, prime Hurwitz integers are considered. On the other hand, considering transmission over Gaussian channel, Hurwitz integers, whose the norm is either a prime integer or not a prime integer, are considered. In this study, we consider Hurwitz integers, the greatest common divisor of components of which is one, i.e., primitive Hurwitz integers. We show, with the help of a proposition, that some primitive Hurwitz integers accompanied by a related modulo function are not suitable for constructing Hurwitz signal constellations. To solve this problem, we show, with the help of a proposition, the existence of primitive Hurwitz integers that have the "division with small remainder" property used to construct the Hurwitz constellations. We also call the set of these integers named as "Encoder Hurwitz Integers" set. Moreover, we examine some properties of the mentioned set. In addition, we investigate the performances of Hurwitz signal constellations, which are constructed accompanied by a related modulo function using Hurwitz integers, each component of which is in half-integers, for transmission over the additive white Gaussian noise (AWGN) channel by means of the constellation figure of merit (CFM), average energy, and signal-to-noise ratio (SNR).
考虑赫维茨整数上的纠错码,考虑素数赫维茨整数。另一方面,考虑高斯信道上的传输,考虑了范数为素数或非素数的Hurwitz整数。在本研究中,我们考虑赫尔维茨整数,其成分的最大公约数为1,即原始赫尔维茨整数。借助于一个命题,我们证明了一些带有相关模函数的原始Hurwitz整数不适合构造Hurwitz信号星座。为了解决这个问题,我们借助一个命题,证明了具有“小余除”性质的原始Hurwitz整数的存在性,这些整数用于构造Hurwitz星座。我们也称这些整数的集合为“Encoder Hurwitz整数”集合。此外,我们还研究了上述集合的一些性质。此外,我们研究了在加性高斯白噪声(AWGN)信道上传输的Hurwitz信号星座的性能,该星座由一个相关的模函数组成,其中每个分量都是半整数,利用星座的优点图(CFM)、平均能量和信噪比(SNR)。
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引用次数: 0
A Research on the Anatomical and Ecological Characteristic of Onosma mollis DC. (Boraginaceae) 软体鱼(Onosma mollis DC)解剖学和生态学特征的研究。(紫草科)
Pub Date : 2023-04-26 DOI: 10.16984/saufenbilder.1209779
Sibel Ulcay
In this study, endemic Onosma mollis DC. it is aimed to examine the anatomical and ecological features of (Boraginaceae) plant in detail and to be compared with the other studies. According to the cross-sections, the root is secondary. Primary pith rays that 2-3 layered are observed. Epidermis is single-layered in stem transverse section. Eglandular hairs in the epidermis are simple, with one and two cells. Glandular hairs are capitate, digitate and with two cells. Just under the epidermis, 2-3 rows of collenchyma cells are formed. Both the upper and the lower surface of leaf is covered with numerous eglandular hairs. Eglandular hairs are 2-3 branched. Glandular hairs are of capitate, digitate and peltate type. The habitat of the O. mollis plant is mountain slopes, meadows, and prairies. The soil in which the species grows is clay and loamy. It is also classified as slightly alkaline, salty, calcareous, low phosphorus and high in potassium. According to its organic matter content, it is in the group of good humus soils.
在本研究中,地方性mollis Onosma DC。目的是详细地研究(琉璃苣科)植物的解剖学和生态学特征,并与其他研究进行比较。从横截面来看,根是次生的。观察到2-3层的初级髓射线。茎横切面表皮单层。表皮的腺毛是单质的,有一个和两个细胞。腺毛头状,指状,具两个细胞。在表皮下,形成2-3排厚壁细胞。叶的上、下表面均被许多腺毛覆盖。腺毛2-3分枝。腺毛头状,指状和盾状。O. mollis植物的栖息地是山坡、草甸和大草原。该物种生长的土壤是粘土和壤土。它也被分类为微碱性、咸性、钙质、低磷和高钾。根据有机质含量,它属于良好腐殖质土壤。
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引用次数: 0
Conversion of Cellulose to 5-HMF in the Presence of Silica-Alumina Catalysts Synthesized by Dual Template at Low Temperature 低温双模板合成二氧化硅-氧化铝催化剂作用下纤维素转化为5-羟甲基糠醛的研究
Pub Date : 2023-04-24 DOI: 10.16984/saufenbilder.1172543
H. L. Hoşgün, Özlem Topçu, E. Z. Hoşgün, B. Bozan
In this study, which incorporates many principles of green chemistry (use of renewable feedstocks, catalysis, improvement of energy efficiency, and harmless solvents and auxiliaries), the single-phase catalytic conversion of cellulose to 5-HMF in over silica-alumina catalysts was investigated. A series of dual-template silica-alumina catalysts with CTAB as the main template and F127 or triethylamine (TEA) as the co-template were synthesized at a low temperature of 60 °C and characterized by XRD, N2 adsorption-desorption technique, FT-IR and pyridine adsorption FT-IR. The surface area is increased by using the second template in silica-alumina catalyst. In addition, the acidity of the surface was changed by using the second template. The cellulose conversion and yield of 5-HMF increased from 36% to 52% and from 3.13% to 4.24%, respectively, due to the properties gained by using the second template. 52% cellulose conversion and 8.13% selectivity of 5-HMF were obtained in aqueous medium, 220 °C and 6 h reaction time with the catalyst using TEA as co-template. Eco-friendly silica catalysts synthesized at low temperatures with a dual template can be considered as a potential alternative for the conversion of cellulose into value-added biobased products.
在本研究中,结合了绿色化学的许多原理(使用可再生原料、催化、提高能源效率、无害溶剂和助剂),研究了纤维素在硅铝催化剂上的单相催化转化为5-羟甲基糠醛。以CTAB为主模板,F127或三乙胺(TEA)为共模板,在60℃低温下合成了一系列双模板硅铝催化剂,并采用XRD、N2吸附-解吸技术、FT-IR和吡啶吸附FT-IR对催化剂进行了表征。在二氧化硅-氧化铝催化剂中使用第二模板增加了比表面积。此外,使用第二种模板可以改变表面的酸度。由于使用第二种模板所获得的性能,5-HMF的纤维素转化率和产率分别从36%提高到52%和3.13%提高到4.24%。以TEA为共模板剂,在220℃、6 h的水溶液条件下,纤维素转化率为52%,5-羟甲基糠醛选择性为8.13%。在低温下用双模板合成的环保二氧化硅催化剂可以被认为是纤维素转化为增值生物基产品的潜在替代品。
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引用次数: 0
Two Significant Factors Affecting the Dimensions of the ZnO Nanorods During Chemical Bath Deposition: Precursor Solution Concentration and HMTA Content 化学浴沉积过程中影响ZnO纳米棒尺寸的两个重要因素:前驱体溶液浓度和HMTA含量
Pub Date : 2023-04-20 DOI: 10.16984/saufenbilder.1241020
Memnune Kardeş, Koray Öztürk
The effects of zinc ion concentration and hexamethylene tetramine (HMTA) content of the aqueous precursor solution on the aspect ratios of the one-dimensional (1D) ZnO nanorods during chemical bath deposition (CBD) were investigated. The ZnO nanorods were grown on these seeded substrates by the low-temperature CBD method at 95 °C for 5 h. In the first part of this investigation the zinc nitrate hexahydrate (ZNH) to HMTA molar ratio was kept constant at a ratio of 1:1 for each of the CBD solutions prepared with different Zn^(+2) ion concentrations of 0.025, 0.035, 0.050, and 0.075 M. The number densities of the nanorods (i.e., number of nanorods per unit area) were increased with the increasing concentration. In the second part, the ZNH to HMTA molar ratio was varied to differ from the 1:1 value and, in turn, to obtain the precursor solutions relatively rich in Zn^(+2) or OH^-ions. Here, the concentration of the precursor solution was kept constant at 0.05 M. The lateral growth perpendicular to the c-axis of the ZnO nanorods was found to be suppressed with the increasing HMTA content (e.g., for the ZNH to HMTA molar ratio of 0.4: 1) due to its capping effect. However, the precursor solution containing an excessive amount of HMTA led to a decrease in the probability of crystal growth, which has been attributed to the OH^- ion enrichment.
研究了化学浴沉积(CBD)过程中锌离子浓度和前驱体溶液中六亚甲基四胺(HMTA)含量对一维ZnO纳米棒长宽比的影响。氧化锌纳米棒生长在这些播种基质由低温CBD方法在95°C 5 h。在这次调查的第一部分六水合硝酸锌(ZNH) HMTA摩尔比率在1:1的比例保持不变的CBD的解决方案准备不同的锌^(+ 2)离子浓度的0.025,0.035,0.050,和0.075 m数密度的纳米棒(即单位面积上的纳米棒)是随着浓度增加。在第二部分中,改变ZNH与HMTA的摩尔比,使其不再是1:1的值,从而得到相对富含Zn^(+2)或OH^-离子的前驱体溶液。当前驱体溶液的浓度为0.05 m时,发现随着HMTA含量的增加(例如,当ZNH与HMTA的摩尔比为0.4:1时),ZnO纳米棒垂直于c轴的横向生长受到抑制。然而,含有过量HMTA的前驱体溶液导致晶体生长概率降低,这归因于OH^-离子的富集。
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引用次数: 0
Venom Peptides of Crotalus atrox Against SARS-Cov-2 Spike Protein and Human ACE2 Receptor by Molecular Docking Analysis 爪蟾抗SARS-Cov-2刺突蛋白与人ACE2受体的分子对接分析
Pub Date : 2023-04-17 DOI: 10.16984/saufenbilder.1265332
S. Ilhan
Venoms are composed of about 100 to 500 pharmacologically active compounds. Less than 0.01% of these compounds have been identified and a significant majority of them act on unknown receptors. Here, the potential Severe Acute Respiratory Syndrome Coronavirus 2 (SARS-CoV-2) activities of selected Crotalus atrox venom peptides (CVPs) including Atrolysin D (AD), vascular apoptosis-inducing protein-1 (VAIP-1), Catrocollastatin (CC), and Calcium-Free Phospholipase A2 (CFP) were investigated via molecular docking analysis. CVPs were docked against human angiotensin-converting enzyme-2 (ACE-2) and 3-chymotrypsin-like protease (3CLpro) viral spike protein. All CVPs had low binding energies to both 3CLpro and ACE2, suggesting that they interacted strongly with the active sites of enzymes, compared to the reference drugs lopinavir and ritonavir. The binding energy of 3CLpro was -139.517 kcal/mol, -96.239 kcal/mol, -121.590 kcal/mol, -259.424 kcal/mol with AD, VAIP-1, CC, and CFP, respectively. CFP showed a very strong binding activity with 3CLpro, suggesting that it could be a very effective compound in inhibiting the SARS-CoV-2 virus. The binding energy of ACE2 was -101.165 kcal/mol, -73.064 kcal/mol, -106.918 kcal/mol, -82.830 kcal/mol with AD, VAIP-1, CC, and CFP, respectively. AD made a much stronger bond with ACE2 than reference drugs, showing that it could be used as a virus-protective component in humans. The results suggest a potential drug candidate for the development of therapeutics against Coronavirus disease 2019 (COVID-19). In vitro and in vivo experiments are needed to confirm these compounds' potential preventive and therapeutic effects.
毒液由大约100到500种具有药理活性的化合物组成。这些化合物中只有不到0.01%被鉴定出来,其中绝大多数作用于未知的受体。本研究通过分子对接分析,研究了Crotalus atrox venom peptide (CVPs)包括atolysin D (AD)、vascular apoptosis-inducing protein-1 (VAIP-1)、Catrocollastatin (CC)和free - free Phospholipase A2 (CFP)的潜在SARS-CoV-2活性。CVPs与人血管紧张素转换酶-2 (ACE-2)和3-凝乳胰蛋白酶样蛋白酶(3CLpro)病毒刺突蛋白对接。与参比药物洛匹那韦和利托那韦相比,所有CVPs与3CLpro和ACE2的结合能都很低,表明它们与酶的活性位点相互作用强烈。3CLpro与AD、VAIP-1、CC和CFP的结合能分别为-139.517 kcal/mol、-96.239 kcal/mol、-121.590 kcal/mol、-259.424 kcal/mol。CFP与3CLpro具有很强的结合活性,可能是抑制SARS-CoV-2病毒非常有效的化合物。ACE2与AD、VAIP-1、CC、CFP的结合能分别为-101.165 kcal/mol、-73.064 kcal/mol、-106.918 kcal/mol、-82.830 kcal/mol。AD与ACE2的结合比对照药物强得多,这表明它可以作为人类病毒保护成分。这些结果为开发针对2019冠状病毒病(COVID-19)的治疗方法提供了一种潜在的候选药物。需要体外和体内实验来证实这些化合物潜在的预防和治疗作用。
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引用次数: 0
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Sakarya University Journal of Science
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