Invited Talk: Analyzing Tandem Mass Spectra: A Graphical Models Perspective
Proceedings of Machine Learning Research vol(2017)
摘要
In the past two decades, the field of proteomics has seen explosive growth, largely due to the development of tandem mass spectrometry (MS/MS). With a complex biological sample as input, a typical MS/MS experiment quickly produces a large (often numbering in the hundreds-of-thousands) collection of spectra representative of the proteins present in the original complex sample. A majority of widely used methods to search and identify MS/MS spectra use scoring functions which rely on static, hand-selected parameters rather than affording the ability to learn parameters and adapt to the widely varying characteristics of MS/MS data. In this talk, we discuss recent work utilizing dynamic Bayesian networks (DBNs) to identify MS/MS spectra. In particular, we discuss a recently proposed DBN for Rapid Identification of Peptides (DRIP) which, in contrast to popular scoring functions, allows efficient generative and discriminative learning of parameters to achieve state-of-theart spectrum-identification accuracy. Furthermore, facilitated by DRIP’s generative nature, we present current innovations leveraging DBNs to significantly enhance many other aspects of MS/MS analysis, such as improving downstream discriminative classification via detailed feature extraction and speeding up identification runtime using trellises and approximate inference.
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