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Improved methods for fluorescence background subtraction from Raman spectra

机译:从拉曼光谱中减去荧光背景的改进方法

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摘要

Raman spectroscopy has attracted interest as a non-invasive optical technique to study the composition and structure of a wide range of materials at the microscopic level. The intrinsic fluorescence background can be orders of magnitude stronger than the Raman scattering, and so, background removal is one of the foremost challenges for quantitative analysis of Raman spectra in many samples. A range of methods anchored in instrumental and computational programming approaches have been proposed for removing fluorescence background signals. An enhanced adaptive weighting scheme for automated fluorescence removal is reported, applicable to both polynomial fitting and penalized least squares approaches. Analysis of the background fitting results for ensembles of simulated spectra suggests that the method is robust and reliable and can significantly improve the background fit over the range of signal, shot noise and background parameters tested, while reducing the subjective nature of the process. The method was also illustrated by application to experimental data generated from aqueous solutions of bulk protein fibrinogen mixed with dextran.
机译:拉曼光谱作为一种非侵入性光学技术已引起人们的兴趣,该技术可在微观水平上研究各种材料的组成和结构。固有的荧光背景可能比拉曼散射强几个数量级,因此,背景去除是许多样品中拉曼光谱定量分析的首要挑战之一。已经提出了锚定在仪器和计算编程方法中的一系列方法来去除荧光背景信号。报道了一种用于自动荧光去除的增强的自适应加权方案,该方案适用于多项式拟合和惩罚最小二乘法。对整个模拟光谱的背景拟合结果的分析表明,该方法是可靠且可靠的,并且可以在信号,散粒噪声和测试的背景参数范围内显着改善背景拟合,同时降低了过程的主观性。该方法还适用于将大分子蛋白纤维蛋白原与右旋糖酐混合的水溶液产生的实验数据。

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