Daiguo Deng, Xiaowei Chen, Ruochi Zhang, Zengrong Lei, Xiaojian Wang, Fengfeng Zhou. XGraphBoost: Extracting Graph Neural Network-Based Features for a Better Prediction of Molecular Properties. Journal of Chemical Information and Computer Sciences, 61(6):2697-2705, 2021. [doi]
@article{DengCZLWZ21,
title = {XGraphBoost: Extracting Graph Neural Network-Based Features for a Better Prediction of Molecular Properties},
author = {Daiguo Deng and Xiaowei Chen and Ruochi Zhang and Zengrong Lei and Xiaojian Wang and Fengfeng Zhou},
year = {2021},
doi = {10.1021/acs.jcim.0c01489},
url = {https://doi.org/10.1021/acs.jcim.0c01489},
researchr = {https://researchr.org/publication/DengCZLWZ21},
cites = {0},
citedby = {0},
journal = {Journal of Chemical Information and Computer Sciences},
volume = {61},
number = {6},
pages = {2697-2705},
}