Automated de novo molecular design by hybrid machine intelligence and rule-driven chemical synthesis

Alexander Button, Daniel Merk, Jan A. Hiss, Gisbert Schneider. Automated de novo molecular design by hybrid machine intelligence and rule-driven chemical synthesis. Nat. Mach. Intell., 1(7):307-315, 2019. [doi]

@article{ButtonMHS19,
  title = {Automated de novo molecular design by hybrid machine intelligence and rule-driven chemical synthesis},
  author = {Alexander Button and Daniel Merk and Jan A. Hiss and Gisbert Schneider},
  year = {2019},
  doi = {10.1038/s42256-019-0067-7},
  url = {https://doi.org/10.1038/s42256-019-0067-7},
  researchr = {https://researchr.org/publication/ButtonMHS19},
  cites = {0},
  citedby = {0},
  journal = {Nat. Mach. Intell.},
  volume = {1},
  number = {7},
  pages = {307-315},
}