Molecular representations in AI-driven drug discovery: a review and practical guide

Laurianne David, Amol Thakkar, Rocío Mercado, Ola Engkvist. Molecular representations in AI-driven drug discovery: a review and practical guide. J. Cheminformatics, 12(1):56, 2020. [doi]

@article{DavidTME20,
  title = {Molecular representations in AI-driven drug discovery: a review and practical guide},
  author = {Laurianne David and Amol Thakkar and Rocío Mercado and Ola Engkvist},
  year = {2020},
  doi = {10.1186/s13321-020-00460-5},
  url = {https://doi.org/10.1186/s13321-020-00460-5},
  researchr = {https://researchr.org/publication/DavidTME20},
  cites = {0},
  citedby = {0},
  journal = {J. Cheminformatics},
  volume = {12},
  number = {1},
  pages = {56},
}