SingleFrag: a deep learning tool for MS/MS fragment and spectral prediction and metabolite annotation
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DOI: 10.1101/2024.11.04.621329
Abstract: Metabolite and small molecule identification via MS/MS involves matching experimental spectra with prerecorded spectra of known compounds. This process is hindered by the current lack of comprehensive reference spectral libraries. To address this gap, we… read more here.
Keywords: deep learning; learning tool; tool fragment; singlefrag deep ... See more keywords