@misc{https://doi.org/10.4121/539c7137-c285-4543-be11-e230a4fca8b7.v1,
  doi = {10.4121/539c7137-c285-4543-be11-e230a4fca8b7.v1},
  url = {},
  author = {Pidko, Evgeny and Chernyshov, Ivan},
  keywords = {DFT calculations, transition metal complexes, in silico screening, high-throughput, automation, coordination chemistry, computational chemistry, hemilability},
  title = {Complete dataset for the publication: MACE: Automated Assessment of Stereochemistry of Transition Metal Complexes and its Applications in Computational Catalysis},
  publisher = {4TU.ResearchData},
  year = {2024},
  copyright = {CC BY 4.0},
}