Enhanced Template-Free Reaction Prediction with Molecular Graphs and Sequence-based Data Augmentation.

@inproceedings{hu-2023-enhanced, author = {Haozhe Hu and Yongquan Jiang and Yan Yang and Jim X. Chen}, editor = {Ingo Frommholz and Frank Hopfgartner and Mark Lee and Michael P. Oakes and Mounia Lalmas-Roelleke and Min Zhang and Rodrygo L. T. Santos}, title = {{Enhanced Template-Free Reaction Prediction with Molecular Graphs and Sequence-based Data Augmentation}}, booktitle = {{Proceedings of the 32nd ACM International Conference on Information and Knowledge Management, CIKM 2023, Birmingham, United Kingdom, October 21-25, 2023}}, pages = {813--822}, publisher = {ACM}, year = {2023}, url = {https://doi.org/10.1145/3583780.3614865}, doi = {https://doi.org/10.1145/3583780.3614865} }