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Reversible jump MCMC approach for peak identification for stroke SELDI mass spectrometry using mixture model

机译:使用混合模型的可逆跳跃MCMC方法用于中风SELDI质谱峰识别

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摘要

Mass spectrometry (MS) has shown great potential in detecting disease-related biomarkers for early diagnosis of stroke. To discover potential biomarkers from large volume of noisy MS data, peak detection must be performed first. This article proposes a novel automatic peak detection method for the stroke MS data. In this method, a mixture model is proposed to model the spectrum. Bayesian approach is used to estimate parameters of the mixture model, and Markov chain Monte Carlo method is employed to perform Bayesian inference. By introducing a reversible jump method, we can automatically estimate the number of peaks in the model. Instead of separating peak detection into substeps, the proposed peak detection method can do baseline correction, denoising and peak identification simultaneously. Therefore, it minimizes the risk of introducing irrecoverable bias and errors from each substep. In addition, this peak detection method does not require a manually selected denoising threshold. Experimental results on both simulated dataset and stroke MS dataset show that the proposed peak detection method not only has the ability to detect small signal-to-noise ratio peaks, but also greatly reduces false detection rate while maintaining the same sensitivity.>Contact:
机译:质谱(MS)在检测疾病相关的生物标记物以早期诊断中风方面显示出巨大潜力。要从大量嘈杂的MS数据中发现潜在的生物标志物,必须先执行峰检测。本文提出了一种新的笔画MS数据自动峰值检测方法。在这种方法中,提出了一种混合模型来对光谱建模。贝叶斯方法用于估计混合模型的参数,马尔可夫链蒙特卡罗方法用于执行贝叶斯推理。通过引入可逆的跳跃方法,我们可以自动估计模型中的峰数。代替将峰检测分为子步骤,所提出的峰检测方法可以同时进行基线校正,降噪和峰识别。因此,它使从每个子步骤引入不可恢复的偏差和错误的风险最小化。另外,这种峰值检测方法不需要手动选择的降噪阈值。在模拟数据集和笔划MS数据集上的实验结果表明,所提出的峰检测方法不仅具有检测小的信噪比峰的能力,而且在保持相同灵敏度的情况下大大降低了错误检测率。> :

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