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Spectroscopic, computational, docking, and cytotoxicity investigations of 5-chloro-2-mercaptobenzimidazole as an anti-breast cancer medication 作为抗乳腺癌药物的 5-氯-2-巯基苯并咪唑的光谱、计算、对接和细胞毒性研究
IF 1.7 4区 化学 Q3 SPECTROSCOPY Pub Date : 2024-09-02 DOI: 10.1080/00387010.2024.2398025
V. S. Kunjumol, S. Jeyavijayan, N. Karthik, S. Sumathi
The vibrations were attributed to 5-chloro-2-mercaptobenzimidazole using FTIR and FT-Raman spectroscopy. The optimized geometrical parameters, IR intensity, and the Raman activity of the vibrationa...
利用傅立叶变换红外光谱和傅立叶变换拉曼光谱将这些振动归因于 5-氯-2-巯基苯并咪唑。优化的几何参数、红外强度以及振动的拉曼活度都有助于确定这些振动的性质。
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引用次数: 0
Ultraviolet visible spectral water chemical oxygen demand detection method based on two deep neural network model 基于两个深度神经网络模型的紫外可见光谱水化学需氧量检测方法
IF 1.7 4区 化学 Q3 SPECTROSCOPY Pub Date : 2024-08-28 DOI: 10.1080/00387010.2024.2395326
Xiaojun Zhang, Yiwen Cai, Feng Wang, Jin Wu, Xiaoyu Liu
Water resources are precious resources around the world, but pollution is becoming increasingly severe. While the degree of damage to water caused by organic pollutants is reflected by chemical oxy...
水资源是全世界的宝贵资源,但污染却日益严重。虽然有机污染物对水的破坏程度可以通过化学氧化剂和生物降解剂反映出来,但这些物质对水的破坏程度却很低。
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引用次数: 0
Two-dimensional low-field nuclear magnetic resonance approach for the detection of metabolic syndrome in human serum 检测人体血清中代谢综合征的二维低场核磁共振方法
IF 1.7 4区 化学 Q3 SPECTROSCOPY Pub Date : 2024-08-20 DOI: 10.1080/00387010.2024.2392713
Yuchen Wu, Xiaowen Jiang, Yi Chen, Zhonghua Ni, Rongsheng Lu
Metabolic syndrome (MetS) has become a major public health challenge in recent years. Nuclear magnetic resonance, as a nondestructive measurement, has been widely used in medical diagnosis and scre...
近年来,代谢综合征(MetS)已成为一项重大的公共卫生挑战。核磁共振作为一种无损测量手段,已被广泛应用于医学诊断和筛查。
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引用次数: 0
Molecular structure, light harvesting effect, electronic, topological behavior and molecular docking and molecular dynamic simulation of (Z)-1-(4-chlorophenyl)-3-(3-(E)-3-(4-chlorophenyl)-3-oxo prop-1-en-1-yl)-phenyl) prop-2-en-1-one—in-vitro assay (Z)-1-(4-氯苯基)-3-(3-(E)-3-(4-氯苯基)-3-氧代丙-1-烯-1-基)-苯基)丙-2-烯-1-酮的分子结构、采光效应、电子学、拓扑行为以及分子对接和分子动力学模拟--体外试验
IF 1.7 4区 化学 Q3 SPECTROSCOPY Pub Date : 2024-08-20 DOI: 10.1080/00387010.2024.2388296
Aarthi K V, Hemamalini Rajagopal, V. S. Jeba Reeda, Fathima Rizwana B, J.N. Cheerlin Mishma, B. Narayana, Shine Kadaikunnan, Jamal M Khaled, A. Manikandan, S. Muthu
(Z)-1-(4-chlorophenyl)-3-(3-((E)-3-(4-chlorophenyl)-3-oxoprop-1-en-1-yl)phenyl)prop-2-en-1-one (CCOP) has been explored through both experimental and theoretical investigation. The density function...
(通过实验和理论研究,对(Z)-1-(4-氯苯基)-3-(3-((E)-3-(4-氯苯基)-3-氧代丙烯-1-基)苯基)丙-2-烯-1-酮(CCOP)进行了探索。密度函数...
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引用次数: 0
Sub-ppm-level detection of nanoplastics using au nanograting and application to disposable plasticware 利用au nanograting技术进行亚ppm级纳米塑料检测并应用于一次性塑料制品
IF 1.7 4区 化学 Q3 SPECTROSCOPY Pub Date : 2024-08-17 DOI: 10.1080/00387010.2024.2393247
Jihyeon Heo, Jinju Kim, Jinhyung Lee, Hojun Lee, Dong-Wook Shin, Sangyeob Lee, Choong-Heui Chung, Hee-Kyung Na, Jung-Sub Wi
The detection of sub-ppm levels of nanoplastics using a surface-enhanced Raman scattering sensor was demonstrated. The proposed Au nanograting as surface-enhanced Raman scattering sensor, fabricate...
利用表面增强拉曼散射传感器对亚ppm级纳米塑料进行了检测。所提出的纳米金雾化表面增强拉曼散射传感器的制造方法是一种新型的表面增强拉曼散射传感器。
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引用次数: 0
Quantitative analysis of multicomponent mixtures of rubber and additives based on terahertz time-domain spectroscopy and Krawtchouk moments 基于太赫兹时域光谱和 Krawtchouk 矩的橡胶和添加剂多组分混合物定量分析
IF 1.7 4区 化学 Q3 SPECTROSCOPY Pub Date : 2024-08-16 DOI: 10.1080/00387010.2024.2390509
Xianhua Yin, Fuqiang Zhang, Mulin Feng, Binchuan Lv, Tao Chen
This paper presents a quantitative analytical method based on terahertz time-domain spectroscopy and chemometrics, which was used to detect the content of diphenyl-p-phenylenediamine in a five-comp...
本文介绍了一种基于太赫兹时域光谱和化学计量学的定量分析方法,该方法用于检测五种成分中二苯基对苯二胺的含量。
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引用次数: 0
Spectroscopic and computational methods in the characterization of deep eutectic solvent, Gallic acid, and Glycerol 表征深共晶溶剂、没食子酸和甘油的光谱和计算方法
IF 1.7 4区 化学 Q3 SPECTROSCOPY Pub Date : 2024-08-08 DOI: 10.1080/00387010.2024.2387804
Pukhrambam Suraj Singh, Th. Gomti Devi
Several researchers have shown experimentally that Gallic acid has antioxidant, anti-inflammatory, and anti-aging properties, signifying its value in skin care. Glycerol has properties, such as inc...
一些研究人员通过实验证明,没食子酸具有抗氧化、消炎和抗衰老的特性,这表明了它在皮肤护理方面的价值。甘油的特性包括增加...
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引用次数: 0
Resolution enhanced two-dimensional correlation infrared spectra of biomolecular changes in muscle tissues of Gambusia affinis 鱼类肌肉组织生物分子变化的分辨率增强型二维相关红外光谱
IF 1.7 4区 化学 Q3 SPECTROSCOPY Pub Date : 2024-07-31 DOI: 10.1080/00387010.2024.2383755
L. Devaraj Stephen, S. Binu Kumari, E. Kavitha, Cicero Cena, M. Karl Chinnu, G. Murugan, S. Karthikeyan
The primary objective of this study is to investigate the effects of Zinc toxicity when fishes are exposed in a controlled environment using two-dimensional correlation spectral analysis. This anal...
本研究的主要目的是利用二维相关光谱分析技术,研究鱼类在受控环境中接触锌毒性时的影响。该分析...
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引用次数: 0
Discrimination of some expired and unexpired drugs under different conditions using Fourier Transform infrared-Attenuated Total Reflectance 利用傅立叶变换红外衰减全反射法在不同条件下鉴别一些过期和未过期药物
IF 1.7 4区 化学 Q3 SPECTROSCOPY Pub Date : 2024-07-30 DOI: 10.1080/00387010.2024.2383189
Sinem Çolak
Repackaging of expired medicines has become common in developed countries and can cause serious health problems. Therefore, the identification of these products is of considerable importance. This ...
在发达国家,过期药品重新包装已成为普遍现象,并可能引发严重的健康问题。因此,对这些产品进行鉴定相当重要。本 ...
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引用次数: 0
Temporal evolution of absorption spectra for diisopropyl methylphosphonate at high temperatures in a shock tube 冲击管中甲基膦酸二异丙酯在高温下吸收光谱的时间演变
IF 1.7 4区 化学 Q3 SPECTROSCOPY Pub Date : 2024-07-27 DOI: 10.1080/00387010.2024.2384609
Kaitlyn McKenzie, Colton Willhardt, Austin Butler, Nick Glumac
Absorption spectra and cross-sections of Diisopropyl Methylphosphonate (DIMP) are measured in argon at temperatures of 600–1250 K in a shock tube using rapid scanning, broadband absorption spectros...
利用快速扫描宽带吸收光谱,在氩气中测量了甲基膦酸二异丙酯(DIMP)在 600-1250 K 温度下在冲击管中的吸收光谱和横截面。
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引用次数: 0
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Spectroscopy Letters
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