Machine and deep learning algorithms have increasingly been applied to solve problems in various areas of knowledge. Among these areas, Chemometrics has been benefited from the application of these algorithms in spectral data analysis. Commonly, algorithms such as Support Vector Machines and Partial Least Squares are applied to spectral datasets to perform classification and regression tasks. In this paper, we present a 1D convolutional neural networks (1D-CNN) to evaluate the effectiveness on spectral data obtained from spectroscopy. In most cases, the spectrum signals are noisy and present overlap among classes. Firstly, we perform extensive experiments including 1D-CNN compared to machine learning algorithms and standard algorithms used in Chemometrics on spectral data classification for the most known datasets available in the literature. Next, spectral samples of the SARS-COV2 virus, which causes the COVID-19, have recently been collected via spectroscopy was used as a case study. Experimental results indicate superior performance of 1D-CNN over machine learning algorithms and standard algorithms, obtaining an average accuracy of 96.5%, specificity of 98%, and sensitivity of 94%. The promissing obtained results indicate the feasibility to use 1D-CNN in automated systems to diagnose COVID-19 and other viral diseases in the future.
翻译:为了解决不同知识领域的问题,越来越多地应用了机器和深层学习算法,在这些领域中,化学测量法从应用这些算法的光谱数据分析中得到好处。通常,支持矢量机和部分最小方程式等算法应用于光谱数据集,以进行分类和回归任务。在本文件中,我们提出了一个1D进化神经网络(1D-CNN),以评价从光谱分析获得的光谱数据的有效性。在大多数情况下,频谱信号是各班之间吵闹和存在的重叠。首先,我们进行了广泛的实验,包括1D-CNN,与机器学习算法和在文献中最已知数据集的光谱数据分类中使用的彩色算法和标准算法进行比较。接着,SARS-COV2病毒的光谱样本(导致COVID-19)最近用光谱分析法采集,作为案例研究。实验结果显示1D-CNN超过机器学习算法和标准算法的优异性表现。首先,我们获得了平均96.5%的精确度、98-D特性,以及未来诊断系统对98-VI结果的敏感性。