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--- |
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license: mit |
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tags: |
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- chemistry |
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- molecular-structure |
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- spectroscopy |
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- nmr |
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- infrared |
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- smiles |
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- transformer |
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- pytorch |
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pipeline_tag: text-generation |
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--- |
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# NMIRacle Model Checkpoints |
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Model checkpoints for **NMIRacle** (NMr-IR orACLE), a deep learning framework for *de novo* molecular structure elucidation from multi-modal spectroscopic data. |
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## Citation |
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```bibtex |
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@article{nmiracle2025, |
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title={NMIRacle: Scalable Structure Elucidation from IR and NMR Spectra}, |
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author={Your Name et al.}, |
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journal={arXiv preprint arXiv:XXXX.XXXXX}, |
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year={2025} |
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} |
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``` |
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## License |
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MIT License |
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