Kernel Approach to Molecular Similarity Based on Iterative Graph Similarity

Matthias Rupp, Ewgenij Proschak, Gisbert Schneider. Kernel Approach to Molecular Similarity Based on Iterative Graph Similarity. Journal of Chemical Information and Computer Sciences, 47(6):2280-2286, 2007. [doi]

@article{RuppPS07,
  title = {Kernel Approach to Molecular Similarity Based on Iterative Graph Similarity},
  author = {Matthias Rupp and Ewgenij Proschak and Gisbert Schneider},
  year = {2007},
  doi = {10.1021/ci700274r},
  url = {http://dx.doi.org/10.1021/ci700274r},
  researchr = {https://researchr.org/publication/RuppPS07},
  cites = {0},
  citedby = {0},
  journal = {Journal of Chemical Information and Computer Sciences},
  volume = {47},
  number = {6},
  pages = {2280-2286},
}