Learning chemistry: exploring the suitability of machine learning for the task of structure-based chemical ontology classification

Janna Hastings, Martin Glauer, Adel Memariani, Fabian Neuhaus, Till Mossakowski. Learning chemistry: exploring the suitability of machine learning for the task of structure-based chemical ontology classification. J. Cheminformatics, 13(1):23, 2021. [doi]

@article{HastingsGMNM21,
  title = {Learning chemistry: exploring the suitability of machine learning for the task of structure-based chemical ontology classification},
  author = {Janna Hastings and Martin Glauer and Adel Memariani and Fabian Neuhaus and Till Mossakowski},
  year = {2021},
  doi = {10.1186/s13321-021-00500-8},
  url = {https://doi.org/10.1186/s13321-021-00500-8},
  researchr = {https://researchr.org/publication/HastingsGMNM21},
  cites = {0},
  citedby = {0},
  journal = {J. Cheminformatics},
  volume = {13},
  number = {1},
  pages = {23},
}