SMILES needs the following packages to be installed beforehand:
Python 3.8+
PyTorch 1.9+
PyTorch-Geometric 1.7
Scikit-learn 0.24+
scipy
Numpy
tqdm
NetworkX
python Smiles.py
@inproceedings{wang2023robust,
title={Robust self-supervised multi-instance learning with structure awareness},
author={Wang, Yejiang and Zhao, Yuhai and Wang, Zhengkui and Wang, Meixia},
booktitle={Proceedings of the AAAI Conference on Artificial Intelligence},
volume={37},
number={8},
pages={10218--10225},
year={2023}
}