The Crux Toolkit for Analysis of Bottom-Up Tandem Mass Spectrometry Proteomics Data.
Attila Kertesz-FarkasFrank Lawrence Nii Adoquaye AcquayeKishankumar BhimaniJimmy K EngWilliam E FondrieCharles GrantMichael R HoopmannAndy LinYang Y LuRobert L MoritzMichael J MacCossWilliam Stafford NoblePublished in: Journal of proteome research (2023)
The Crux tandem mass spectrometry data analysis toolkit provides a collection of algorithms for analyzing bottom-up proteomics tandem mass spectrometry data. Many publications have described various individual components of Crux, but a comprehensive summary has not been published since 2014. The goal of this work is to summarize the functionality of Crux, focusing on developments since 2014. We begin with empirical results demonstrating our recently implemented speedups to the Tide search engine. Other new features include a new score function in Tide, two new confidence estimation procedures, as well as three new tools: Param-medic for estimating search parameters directly from mass spectrometry data, Kojak for searching cross-linked mass spectra, and DIAmeter for searching data independent acquisition data against a sequence database.
Keyphrases
- tandem mass spectrometry
- liquid chromatography
- mass spectrometry
- ultra high performance liquid chromatography
- high performance liquid chromatography
- gas chromatography
- data analysis
- simultaneous determination
- electronic health record
- high resolution
- solid phase extraction
- high resolution mass spectrometry
- big data
- randomized controlled trial
- capillary electrophoresis
- artificial intelligence
- deep learning
- adverse drug
- ms ms
- optical coherence tomography