Exploring Deep Learning of Quantum Chemical Properties for Absorption, Distribution, Metabolism, and Excretion Predictions

Megan A. Lim, Song Yang, Huanghao Mai, Alan C. Cheng. Exploring Deep Learning of Quantum Chemical Properties for Absorption, Distribution, Metabolism, and Excretion Predictions. Journal of Chemical Information and Computer Sciences, 62(24):6336-6341, 2022. [doi]

@article{LimYMC22,
  title = {Exploring Deep Learning of Quantum Chemical Properties for Absorption, Distribution, Metabolism, and Excretion Predictions},
  author = {Megan A. Lim and Song Yang and Huanghao Mai and Alan C. Cheng},
  year = {2022},
  doi = {10.1021/acs.jcim.2c00245},
  url = {https://doi.org/10.1021/acs.jcim.2c00245},
  researchr = {https://researchr.org/publication/LimYMC22},
  cites = {0},
  citedby = {0},
  journal = {Journal of Chemical Information and Computer Sciences},
  volume = {62},
  number = {24},
  pages = {6336-6341},
}