[HTML][HTML] A novel informatics concept for high-throughput shotgun lipidomics based on the molecular fragmentation query language

R Herzog, D Schwudke, K Schuhmann, JL Sampaio… - Genome biology, 2011 - Springer
Genome biology, 2011Springer
Shotgun lipidome profiling relies on direct mass spectrometric analysis of total lipid extracts
from cells, tissues or organisms and is a powerful tool to elucidate the molecular
composition of lipidomes. We present a novel informatics concept of the molecular
fragmentation query language implemented within the LipidXplorer open source software kit
that supports accurate quantification of individual species of any ionizable lipid class in
shotgun spectra acquired on any mass spectrometry platform.
Abstract
Shotgun lipidome profiling relies on direct mass spectrometric analysis of total lipid extracts from cells, tissues or organisms and is a powerful tool to elucidate the molecular composition of lipidomes. We present a novel informatics concept of the molecular fragmentation query language implemented within the LipidXplorer open source software kit that supports accurate quantification of individual species of any ionizable lipid class in shotgun spectra acquired on any mass spectrometry platform.
Springer