Mathematical deep learning for pose and binding affinity prediction and ranking in D3R Grand Challenges

Duc Duy Nguyen, Zixuan Cang, Kedi Wu, Menglun Wang, Yin Cao, Guo-Wei Wei. Mathematical deep learning for pose and binding affinity prediction and ranking in D3R Grand Challenges. Journal of Computer-Aided Molecular Design, 33(1):71-82, 2019. [doi]

@article{NguyenCWWCW19,
  title = {Mathematical deep learning for pose and binding affinity prediction and ranking in D3R Grand Challenges},
  author = {Duc Duy Nguyen and Zixuan Cang and Kedi Wu and Menglun Wang and Yin Cao and Guo-Wei Wei},
  year = {2019},
  doi = {10.1007/s10822-018-0146-6},
  url = {https://doi.org/10.1007/s10822-018-0146-6},
  researchr = {https://researchr.org/publication/NguyenCWWCW19},
  cites = {0},
  citedby = {0},
  journal = {Journal of Computer-Aided Molecular Design},
  volume = {33},
  number = {1},
  pages = {71-82},
}