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METHOD AND SYSTEM FOR DETECTING PEPTIDE PEAKS IN HPLC-MS SIGNALS

机译:检测HPLC-MS信号中肽峰的方法和系统

摘要

The present invention relates to a method, a computer tool and a system for detecting peptide peaks in measurement signals (11) generated by HPLC-MS instruments. The method comprises the steps of: providing an intensity column vector (SIC) representative of the elution values at a specific mass value (m/z) of the measurement signal (11); performing a wavelet decomposition (15) of such values of said intensity column vector (SIC) to generate a first processed vector (16) representative of the smoothed intensity values of the intensity column vector (SIC); providing a threshold value (S) and performing a wavelet decomposition (17) as a function of the value of said threshold (S) to generate the second processed vector (18) representative of said intensity column vector (SIC) cleaned of any oscillations generated by stochastic noise (e(t)); processing said first processed vector (16) and said second processed vector (18) to generate a third processed vector (19) identifying the baseline values of said intensity column vector (SIC); processing said intensity column vector (SIC) and said second (18) and third (19) vectors to generate e filtered vector (20) identifying any peak value (ZJ) below the background noise (12).
机译:本发明涉及一种用于检测由HPLC-MS仪器产生的测量信号(11)中肽峰的方法,计算机工具和系统。该方法包括以下步骤:在测量信号(11)的特定质量值(m / z)处提供代表洗脱值的强度柱矢量(SIC);对所述强度列矢量(SIC)的这种值进行小波分解(15),以生成代表强度列矢量(SIC)的平滑强度值的第一处理矢量(16);提供阈值(S),并根据所述阈值(S)的值执行小波分解(17),以生成表示所述强度列矢量(SIC)的第二处理矢量(18),该第二处理矢量已清除产生的任何振荡随机噪声(e(t));处理所述第一处理向量(16)和所述第二处理向量(18)以生成识别所述强度列向量(SIC)的基线值的第三处理向量(19);处理所述强度列向量(SIC)以及所述第二(18)和第三(19)向量,以生成过滤后的向量(20),以识别出低于背景噪声(12)的任何峰值(ZJ)。

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