Marcus Ludwig
8PUBLICATIONS
44CO-AUTHORS
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Publications (8)
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|Oct 28, 2025
Barcode-free hit discovery from massive libraries enabled by automated small molecule structure annotation.Edith van der Nol, Nils Alexander Haupt, Qing Qing Gao
|Jan 09, 2025
Coverage bias in small molecule machine learning.Fleming Kretschmer, Jan Seipp, Marcus Ludwig
|Mar 29, 2023
MAD HATTER Correctly Annotates 98% of Small Molecule Tandem Mass Spectra Searching in PubChem.Martin A Hoffmann, Fleming Kretschmer, Marcus Ludwig
|Oct 15, 2021
High-confidence structural annotation of metabolites absent from spectral libraries.Martin A Hoffmann, Louis-Félix Nothias, Marcus Ludwig
|Nov 24, 2020
Systematic classification of unknown metabolites using high-resolution fragmentation mass spectra.Kai Dührkop, Louis-Félix Nothias, Markus Fleischauer
|Nov 17, 2020
Chemically informed analyses of metabolomics mass spectrometry data with Qemistree.Anupriya Tripathi, Yoshiki Vázquez-Baeza, Julia M Gauglitz
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Frequent Collaborators
8 joint publications
Sebastian Böcker
5 joint publications
Kai Dührkop
4 joint publications
Markus Fleischauer
4 joint publications
Pieter C Dorrestein
3 joint publications
Martin A Hoffmann
2 joint publications
Alexander A Aksenov
2 joint publications
Louis-Félix Nothias
2 joint publications
Juho Rousu
2 joint publications
Michael Witting
2 joint publications
Justin J J van der Hooft
