Structure-Based de Novo Molecular Generator Combined with Artificial Intelligence and Docking Simulations

Biao Ma, Kei Terayama, Shigeyuki Matsumoto, Yuta Isaka, Yoko Sasakura, Hiroaki Iwata, Mitsugu Araki, Yasushi Okuno. Structure-Based de Novo Molecular Generator Combined with Artificial Intelligence and Docking Simulations. Journal of Chemical Information and Computer Sciences, 61(7):3304-3313, 2021. [doi]

@article{MaTMISIAO21,
  title = {Structure-Based de Novo Molecular Generator Combined with Artificial Intelligence and Docking Simulations},
  author = {Biao Ma and Kei Terayama and Shigeyuki Matsumoto and Yuta Isaka and Yoko Sasakura and Hiroaki Iwata and Mitsugu Araki and Yasushi Okuno},
  year = {2021},
  doi = {10.1021/acs.jcim.1c00679},
  url = {https://doi.org/10.1021/acs.jcim.1c00679},
  researchr = {https://researchr.org/publication/MaTMISIAO21},
  cites = {0},
  citedby = {0},
  journal = {Journal of Chemical Information and Computer Sciences},
  volume = {61},
  number = {7},
  pages = {3304-3313},
}