Deep-learning-driven spectral image analysis for intelligent monitoring of multiple pesticides and antibiotics.

IF 6.1 1区 化学 Q1 CHEMISTRY, ANALYTICAL
Zhizhi Fu, Lu Liu, Qiannan Duan, Liulu Yao, Qianru Wan, Chi Zhou, Weidong Wu, Fei Wang, Jianchao Lee
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Abstract

With the widespread use of pesticides and antibiotics in agriculture and healthcare, their associated environmental pollution and potential health hazards have emerged as a global concern. This study presents a novel deep learning-based spectral image analysis approach that is dedicated to the intelligent monitoring of multiple pesticides and antibiotics in agricultural water bodies. A total of 6100 samples containing glyphosate (GL), bentazone (BE), benzylpenicillin potassium (BP), and tetracycline hydrochloride (TH) at concentrations range of 3.8-550 μg/L were prepared. After the samples were mixed with selected composite chromogenic reagents, the specific absorbance characteristics of the stabilized reaction mixtures were measured using a custom-designed spectrometer. The preprocessed spectral data were used to train a fine-tuned ResNet-50 deep learning model. By establishing mappings between spectral features and reference concentrations, the model effectively predicted unknown pollutant concentrations. The results indicated that the proposed method enables rapid and simultaneous detection of GL, BE, BP and TH. Under laboratory conditions, the coefficient of determination exceeded 0.993, the reliable prediction rate was over 80 % in the concentration range of 10-550 μg/L. The limits of detection for GL, BE, BP, and TH were 0.23, 0.32, 0.38, and 0.28 μg/L, respectively. In addition, the frequency of abnormal predictions for natural water samples exhibited an increase over the concentration range of 3.8-10 μg/L, while the overall accuracy remained relatively high. Our research provides a new perspective on the rapid identification of pesticides and antibiotics. In the future, we hope this method can offer a timely, cost-effective and scalable solution for the early warning and real-time tracking of pollutants in water bodies.

基于深度学习驱动的光谱图像分析,用于多种农药和抗生素的智能监测。
随着农药和抗生素在农业和医疗保健领域的广泛使用,其相关的环境污染和潜在的健康危害已成为全球关注的问题。本文提出了一种新的基于深度学习的光谱图像分析方法,用于农业水体中多种农药和抗生素的智能监测。制备草甘膦(GL)、苯并酮(BE)、青霉素钾(BP)、盐酸四环素(TH)浓度为3.8 ~ 550 μg/L的样品6100份。将样品与选定的复合显色试剂混合后,使用特制的光谱仪测量稳定反应混合物的比吸光度特性。预处理后的光谱数据用于训练微调后的ResNet-50深度学习模型。通过建立光谱特征与参考浓度之间的映射关系,该模型有效地预测了未知污染物浓度。结果表明,该方法能够快速、同时检测GL、BE、BP和TH。在实验室条件下,测定系数大于0.993,在10 ~ 550 μg/L浓度范围内,可靠预测率达80%以上。GL、BE、BP、TH的检出限分别为0.23、0.32、0.38、0.28 μg/L。此外,在3.8 ~ 10 μg/L范围内,自然水样异常预测频次有所增加,但总体精度保持较高。本研究为农药和抗生素的快速鉴定提供了新的思路。未来,我们希望该方法能够为水体污染物的预警和实时跟踪提供及时、经济、可扩展的解决方案。
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来源期刊
Talanta
Talanta 化学-分析化学
CiteScore
12.30
自引率
4.90%
发文量
861
审稿时长
29 days
期刊介绍: Talanta provides a forum for the publication of original research papers, short communications, and critical reviews in all branches of pure and applied analytical chemistry. Papers are evaluated based on established guidelines, including the fundamental nature of the study, scientific novelty, substantial improvement or advantage over existing technology or methods, and demonstrated analytical applicability. Original research papers on fundamental studies, and on novel sensor and instrumentation developments, are encouraged. Novel or improved applications in areas such as clinical and biological chemistry, environmental analysis, geochemistry, materials science and engineering, and analytical platforms for omics development are welcome. Analytical performance of methods should be determined, including interference and matrix effects, and methods should be validated by comparison with a standard method, or analysis of a certified reference material. Simple spiking recoveries may not be sufficient. The developed method should especially comprise information on selectivity, sensitivity, detection limits, accuracy, and reliability. However, applying official validation or robustness studies to a routine method or technique does not necessarily constitute novelty. Proper statistical treatment of the data should be provided. Relevant literature should be cited, including related publications by the authors, and authors should discuss how their proposed methodology compares with previously reported methods.
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