Ultra-fast retroactive processing of liquid chromatography high-resolution full-scan Orbitrap mass spectrometry data in anti-doping screening of human urine.
Arjen LommenAbdurzag ElaradiAriadni VonapartiMarco BloklandMichel W NielenKhadija Ali SaadWadha Masoud AbushreedaPeter HorvatovichAmal Essa Al-MuraikhiMohammed Al-MaadheedCostas GeorgakopoulosPublished in: Rapid communications in mass spectrometry : RCM (2020)
The freeware MetAlign software and its automatic searching module HR_MS_Search facilitated the retroactive reprocessing of reduced full-scan high-resolution liquid chromatography/mass spectrometry screening data files and created a new tool in anti-doping laboratories' network.
Keyphrases
- mass spectrometry
- liquid chromatography
- high resolution
- tandem mass spectrometry
- high resolution mass spectrometry
- gas chromatography
- ultra high performance liquid chromatography
- high performance liquid chromatography
- electronic health record
- computed tomography
- simultaneous determination
- capillary electrophoresis
- endothelial cells
- solid phase extraction
- big data
- data analysis
- machine learning
- induced pluripotent stem cells
- high speed
- transition metal
- magnetic resonance imaging
- artificial intelligence