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Mass spectrometric method and MALDI-TOF mass spectrometer

机译:质谱法和MALDI-TOF质谱仪

摘要

A method of normalising the spectral intensities of mass spectrometry data comprises (i) forming an intensity profile for each individual spectrum, wherein the intensity profile describes the statistical distribution of intensity values within different mass ranges; (ii) forming an average reference profile for an ensemble of spectra; and (iii) transforming the individual spectra such that their intensity profiles correspond to the reference profile. The intensity profile may be formed by dividing the mass axis into sub-intervals, calculating quantile values for each sub-interval, and transforming the quantile values by computing the logarithms and calculating the differences between successive values. A reference profile may be calculated by determining the arithmetic mean of the individual intensity profiles. An individual spectrum may then be normalised to the reference profile by transforming the reference profile back into quantile values, considering the quantile values of the individual spectrum and of the reference profile as reference points of a transfer function, and applying the transfer function to intensity values of the individual spectrum.
机译:一种将质谱数据的光谱强度归一化的方法,包括:(i)为每个单独的光谱形成强度分布图,其中该强度分布图描述了不同质量范围内强度值的统计分布; (ii)形成一组光谱的平均参考曲线; (iii)变换各个光谱,使其强度轮廓与参考轮廓相对应。可以通过将质量轴划分为子间隔,为每个子间隔计算分位数,并通过计算对数并计算连续值之间的差来转换分位数来形成强度分布图。可以通过确定各个强度分布的算术平均值来计算参考分布。然后,可以通过将参考轮廓转换回分位数,将单个光谱和参考轮廓的分位数视为传递函数的参考点,并将传递函数应用于强度值,将单个光谱归一化为参考轮廓各个频谱。

著录项

  • 公开/公告号GB2568778A

    专利类型

  • 公开/公告日2019-05-29

    原文格式PDF

  • 申请/专利权人 BRUKER DALTONIK GMBH;

    申请/专利号GB20180015166

  • 发明设计人 TOBIAS BOSKAMP;DELF LACHMUND;

    申请日2018-09-18

  • 分类号H01J49;

  • 国家 GB

  • 入库时间 2022-08-21 11:43:05

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