光谱学与光谱分析, 2015, 35 (5): 1187, 网络出版: 2015-05-26  

基于凸组合核函数的化合物太赫兹透射光谱分类

Classification of THz Transmission Spectrum Based on Kevnel Function of Convex Combination
作者单位
1 昆明理工大学信息工程与自动化学院, 云南 昆明 650504
2 昆明理工大学材料科学与工程学院, 云南 昆明 650093
摘要
物质的太赫兹光谱包含着非常丰富的物理和化学信息.它对化合物晶体具有高的灵敏度、单光子能量低等特点.但受到检测人员知识背景、背景噪声、识别算法精度等因素的影响,光谱样本识别准确率和效率较低.为了提高对太赫兹光谱的检测能力,提出应用基于凸组合核函数的support vector machines(SVM)对化合物的THz脉冲透射谱进行分类.在使用小波变换对数据进行滤波预处理之后,提取了传统波峰、波谷位置特征和term frequency-inverse document frequency(TF-IDF) 最大间隔特征.TF-IDF方法使用信息论的原理确定每个采样点的权重,选择权重较大的点作为特征.针对太赫兹透射谱特征相似、维数较低带来的分类困难问题,构建基于凸组合核函数的SVM分类模型.并利用核评价的方法,通过高维非线性规划方程求解最优凸组合参数.当最优凸组合参数被确定时,构建分类模型进行分类和预测.相比较于单一核函数,凸组合核函数将透射谱特征与分类模型融合起来.对于不同的检测样本,数据经过凸组合核函数映射到高维空间后,特征具有更显著的区分度.使用不同的太赫兹透射谱样本进行分类实验,结果表明,分类准确率得到极大提高.
Abstract
In the present paper,support vector machine(SVM) based on convex combination kernel function will be used for classification of THz pulse transmission spectra.Wavelet transform is used in data pre-processing.Peaks and valleys are regarded as location features of THz pulse transmission spectra,which are injected into maximum interval features of term frequency-inverse document frequency(TF-IDF).We can conclude weight of each sampling point from the information theory.The weight represents the possibility that sampling point becomes feature.According to the situation that different terahertz-transmission spectra are lack of obvious features,we composed a SVM classification model based on convex combination kernel function.Evaluation function should be used as an evaluation method for obtaining the parameters of optimal convex combination to achieve a better accuracy.When the optimal parameter of kenal founction was determined,we should compose the model for process of classification and prediction.Compared with the single kernel function,the method can be combined with transmission spectroscopic features with classification model iteratively.Thanks to the dimensional mapping process,outstanding margin of features can be gained for the samples of different terahertz transmission spectrum.We carried out experiments using different samples The results demonstrated that the new approach is on par or superior in terms of accuracy and much better in feature fusion than SVM with single kernel function.

王瑞琦, 沈韬, 马帅, 郭剑毅, 余正涛. 基于凸组合核函数的化合物太赫兹透射光谱分类[J]. 光谱学与光谱分析, 2015, 35(5): 1187. WANG Rui-qi, SHEN Tao, MA Shuai, GUO Jian-yi, YU Zheng-tao. Classification of THz Transmission Spectrum Based on Kevnel Function of Convex Combination[J]. Spectroscopy and Spectral Analysis, 2015, 35(5): 1187.

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