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Please kindly cite our papers if you use the data/code/model.
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## Credits
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We thanks all contributors from the community for their suggestions, bug reports and chemistry advices. Currently unimol-tools is maintained by Yaning Cui, Xiaohong Ji, Zhifeng Gao from DP Technology and AI for Science Insitution, Beijing.
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Please kindly cite our papers if you use this tools.
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@inproceedings{
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zhou2023unimol,
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title={Uni-Mol: A Universal 3D Molecular Representation Learning Framework},
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author={Gengmo Zhou and Zhifeng Gao and Qiankun Ding and Hang Zheng and Hongteng Xu and Zhewei Wei and Linfeng Zhang and Guolin Ke},
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booktitle={The Eleventh International Conference on Learning Representations },
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year={2023},
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url={https://openreview.net/forum?id=6K2RM6wVqKu}
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}
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@article{gao2023uni,
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title={Uni-qsar: an auto-ml tool for molecular property prediction},
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author={Gao, Zhifeng and Ji, Xiaohong and Zhao, Guojiang and Wang, Hongshuai and Zheng, Hang and Ke, Guolin and Zhang, Linfeng},
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