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A Hidden Markov Model Based Scoring Function for Mass Spectrometry Database Search

机译:基于隐马尔可夫模型的质谱数据库评分函数

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摘要

An accurate scoring function for database search is crucial for peptide identification using tandem mass spectrometry. Although many mathematical models have been proposed to score peptides against tandem mass spectra, we design a unique method (called HMMscore) that combines information on consecutive ions, ie, b_i and b_(i+1), and complementary ions, ie, b_i and y_(n-i) for a peptide of n amino acids, plus information on machine accuracy and mass peak intensity, into a hidden Markov model (HMM). In addition, we develop a way to calculate statistical significance of the HMM scores. We implement the method and test them on experimental data. The results show that the accuracy of our method is high compared to MASCOT, and that the false positive rate of HMMscore is low.
机译:数据库搜索的准确评分功能对于使用串联质谱的肽段鉴定至关重要。尽管已经提出了许多数学模型来针对串联质谱对肽进行评分,但是我们设计了一种独特的方法(称为HMMscore),该方法结合了有关连续离子(即b_i和b_(i + 1))和互补离子(即b_i和b)的信息将n个氨基酸的肽的y_(ni)加上有关机器精度和质量峰强度的信息,转换为隐马尔可夫模型(HMM)。此外,我们开发了一种计算HMM分数的统计显着性的方法。我们实施该方法并在实验数据上对其进行测试。结果表明,与MASCOT相比,本方法的准确性较高,而HMMscore的假阳性率较低。

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