Biological Filtering and Substrate Promiscuity Prediction for Annotating Untargeted Metabolomics
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DOI: 10.3390/metabo10040160
Abstract: Mass spectrometry coupled with chromatography separation techniques provides a powerful platform for untargeted metabolomics. Determining the chemical identities of detected compounds however remains a major challenge. Here, we present a novel computational workflow, termed extended… read more here.
Keywords: substrate promiscuity; biological filtering; model; metabolic model ... See more keywords