基于圆域谱重建滤波与卷积神经网络相结合的呼气中痕量异戊二烯实时检测。

IF 6.7 1区 化学 Q1 CHEMISTRY, ANALYTICAL
Fei Xie, Mu Li, Jie Gao, Feifei Liu, Rui Zhu, Shufeng Xu and Yungang Zhang*, 
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引用次数: 0

摘要

呼气中微量异戊二烯的检测为肺癌诊断提供了一种无创方法。然而,干扰成分的存在和呼吸中异戊二烯的十亿分之一(ppb)浓度水平使检测复杂化。在这项研究中,我们提出了一种基于圆域重构滤波和卷积神经网络(CNN)的光学传感器,首次实现了使用紫外微分光学吸收光谱(UV-DOAS)实时检测呼吸异戊二烯。首先,利用UV-DOAS技术获得了异戊二烯的微分吸收光谱,并分析了水蒸气等干扰成分对光谱特性的影响。其次,我们提出了一种新的圆域重构滤波方法,该方法通过离散化干扰吸收特征,有效地减轻了噪声,消除了氨(NH3)和一氧化氮(NO)等成分的干扰。通过将吸收特征映射到圆域,该滤波方法消除了离散噪声和干扰,为痕量气体检测和光谱分析提供了新的视角。基于过滤后的光谱,建立了CNN模型来反演异戊二烯浓度。实验结果表明,该传感器的检测限为3.98 ppb·m,可提供21.32至1254.20 ppb范围内的准确实时呼吸异戊二烯传感。人体样本的测试结果进一步证明了传感器在检测呼吸中痕量异戊二烯方面的有效性。我们的传感器不仅显示了异戊二烯检测的应用潜力,而且还推进了宽带光谱在呼吸分析中的应用。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Real-Time Detection of Trace Breath Isoprene Based on Circular Domain Spectral Reconstruction Filtering Combined with Convolutional Neural Network

Real-Time Detection of Trace Breath Isoprene Based on Circular Domain Spectral Reconstruction Filtering Combined with Convolutional Neural Network

The detection of trace isoprene in breath provides a noninvasive method for lung cancer diagnosis. However, the presence of interfering components and the parts per billion (ppb) concentration levels of isoprene in breath complicate detection. In this study, we propose an optical sensor based on circular domain reconstruction filtering and convolutional neural network (CNN), enabling the real-time detection of breath isoprene using ultraviolet differential optical absorption spectroscopy (UV-DOAS) for the first time. First, we obtained the differential absorption spectra of isoprene using UV-DOAS and analyzed the impact of interfering components including water vapor (H2O) on the spectral characteristics. Second, we proposed a novel circular domain reconstruction filtering method that effectively mitigates noise and removes interference from components including ammonia (NH3) and nitric oxide (NO) by discretizing disturbance absorption features. By mapping the absorption features to the circular domain, the proposed filtering method eliminates discrete noise and interference, providing a novel perspective on trace gas detection and spectral analysis. Based on the filtered spectra, a CNN model was constructed to invert isoprene concentration. Laboratory results show that the sensor has a detection limit of 3.98 ppb·m and provides accurate and real-time breath isoprene sensing ranging from 21.32 to 1254.20 ppb. Test results from human samples further demonstrate the effectiveness of the sensor in detecting trace isoprene in breath. Our sensor not only shows potential for application in isoprene detection but also advances the use of broadband spectroscopy in breath analysis.

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来源期刊
Analytical Chemistry
Analytical Chemistry 化学-分析化学
CiteScore
12.10
自引率
12.20%
发文量
1949
审稿时长
1.4 months
期刊介绍: Analytical Chemistry, a peer-reviewed research journal, focuses on disseminating new and original knowledge across all branches of analytical chemistry. Fundamental articles may explore general principles of chemical measurement science and need not directly address existing or potential analytical methodology. They can be entirely theoretical or report experimental results. Contributions may cover various phases of analytical operations, including sampling, bioanalysis, electrochemistry, mass spectrometry, microscale and nanoscale systems, environmental analysis, separations, spectroscopy, chemical reactions and selectivity, instrumentation, imaging, surface analysis, and data processing. Papers discussing known analytical methods should present a significant, original application of the method, a notable improvement, or results on an important analyte.
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