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S. Kutuzova

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Biochemistry· 1

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Research Focus:benchmarking· 1 Approach:deep learning· 1 Research Focus:drug response / drug discovery· 1 Research Focus:metabolism & bioenergetics· 1 Assay:metabolomics· 1 Approach:variational autoencoder· 1

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C. Igel· 1 shared D. McCloskey· 1 shared M. Nielsen· 1 shared

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2021-2021 · peak 1/yr

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1 shared paperBiochemistry

C. Igel

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1 paper

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BiochemistrybioRxivPreprintAug 3, 2021

Bi-modal Variational Autoencoders for Metabolite Identification Using Tandem Mass Spectrometry

S. Kutuzova, C. Igel, M. Nielsen, D. McCloskey

The paper introduces a bi-modal variational autoencoder to identify metabolites from tandem mass spectrometry data by learning from unpaired molecule structures and spectra.

DOI 10.1101/2021.08.03.454944

metabolomicsdeep learning

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