Guided analysis of ambient ionization mass spectrometry data with the MQ_Assistant.

Héctor Guillén-AlonsoNancy Shyrley García-RojasRobert Winkler

Published in: Rapid communications in mass spectrometry : RCM (2023)

The MQ_Assistant helps novices and experienced users to develop workflows for (AI)MS data processing. The interactive procedure supports the quick finding of appropriate settings. These parameters can be exported and reused in future projects. The stepwise operation with visual feedback also suggests the use of the MQ_Assistant in education.

Keyphrases

mass spectrometry
electronic health record
gas chromatography
big data
quality improvement
air pollution
liquid chromatography
artificial intelligence
healthcare
multiple sclerosis
ms ms
high resolution
current status
high performance liquid chromatography
capillary electrophoresis
machine learning