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Published in 2022 at "Bioinformatics"
DOI: 10.1093/bioinformatics/btad078
Abstract: Annotation of the mass signals is still the biggest bottleneck for the untargeted mass spectrometry analysis of complex mixtures. Molecular networks are being increasingly adopted by the mass spectrometry community as a tool to annotate…
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Keywords:
annotation propagation;
random walks;
chemwalker;
molecular networks ... See more keywords