@article{KontouWalterAlkaetal.2023, author = {Eftychia E. Kontou and Axel Walter and Oliver Alka and Julianus Pfeuffer and Timo Sachsenberg and Omkar Mohite and Matin Nuhamunanda and Oliver Kohlbacher and Tilmann Weber}, title = {UmetaFlow: An untargeted metabolomics workflow for high-throughput data processing and analysis}, journal = {Journal of Cheminformatics}, volume = {15}, doi = {10.1186/s13321-023-00724-w}, year = {2023}, }