Coloring Molecules with Explainable Artificial Intelligence for Preclinical Relevance Assessment

José Jiménez-Luna, Miha Skalic, Nils Weskamp, Gisbert Schneider. Coloring Molecules with Explainable Artificial Intelligence for Preclinical Relevance Assessment. Journal of Chemical Information and Computer Sciences, 61(3):1083-1094, 2021. [doi]

@article{Jimenez-LunaSWS21,
  title = {Coloring Molecules with Explainable Artificial Intelligence for Preclinical Relevance Assessment},
  author = {José Jiménez-Luna and Miha Skalic and Nils Weskamp and Gisbert Schneider},
  year = {2021},
  doi = {10.1021/acs.jcim.0c01344},
  url = {https://doi.org/10.1021/acs.jcim.0c01344},
  researchr = {https://researchr.org/publication/Jimenez-LunaSWS21},
  cites = {0},
  citedby = {0},
  journal = {Journal of Chemical Information and Computer Sciences},
  volume = {61},
  number = {3},
  pages = {1083-1094},
}