Fréchet ChemNet Distance: A Metric for Generative Models for Molecules in Drug Discovery

Kristina Preuer, Philipp Renz, Thomas Unterthiner, Sepp Hochreiter, Günter Klambauer. Fréchet ChemNet Distance: A Metric for Generative Models for Molecules in Drug Discovery. Journal of Chemical Information and Computer Sciences, 58(9):1736-1741, 2018. [doi]

@article{PreuerRUHK18,
  title = {Fréchet ChemNet Distance: A Metric for Generative Models for Molecules in Drug Discovery},
  author = {Kristina Preuer and Philipp Renz and Thomas Unterthiner and Sepp Hochreiter and Günter Klambauer},
  year = {2018},
  doi = {10.1021/acs.jcim.8b00234},
  url = {https://doi.org/10.1021/acs.jcim.8b00234},
  researchr = {https://researchr.org/publication/PreuerRUHK18},
  cites = {0},
  citedby = {0},
  journal = {Journal of Chemical Information and Computer Sciences},
  volume = {58},
  number = {9},
  pages = {1736-1741},
}