@article{automaticidentificationofchemicalmoietie,
  title = {Automatic Identification of Chemical Moieties},
  author = {Jonas Lederer and Michael Gastegger and Kristof T. Schütt and Michael Kampffmeyer and Klaus-Robert Müller and Oliver T. Unke},
  year = {2022},
  eprint = {2203.16205},
  archivePrefix = {arXiv},
  url = {https://arxiv.org/abs/2203.16205v2},
}