DRlinker: Deep Reinforcement Learning for Optimization in Fragment Linking Design

Youhai Tan, Lingxue Dai, Weifeng Huang, Yinfeng Guo, Shuangjia Zheng, Jinping Lei, Hongming Chen, Yuedong Yang. DRlinker: Deep Reinforcement Learning for Optimization in Fragment Linking Design. Journal of Chemical Information and Computer Sciences, 62(23):5907-5917, 2022. [doi]

@article{TanDHGZLCY22,
  title = {DRlinker: Deep Reinforcement Learning for Optimization in Fragment Linking Design},
  author = {Youhai Tan and Lingxue Dai and Weifeng Huang and Yinfeng Guo and Shuangjia Zheng and Jinping Lei and Hongming Chen and Yuedong Yang},
  year = {2022},
  doi = {10.1021/acs.jcim.2c00982},
  url = {https://doi.org/10.1021/acs.jcim.2c00982},
  researchr = {https://researchr.org/publication/TanDHGZLCY22},
  cites = {0},
  citedby = {0},
  journal = {Journal of Chemical Information and Computer Sciences},
  volume = {62},
  number = {23},
  pages = {5907-5917},
}