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update readme

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  1. README.md +1 -1
  2. qm_calculations/README.md +0 -11
README.md CHANGED
@@ -27,7 +27,7 @@ If you use this data, please cite:
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  ```bibtex
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  @article{baumer-gallegos2025prism,
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- title={PRISM (Parallelized Reaction-rates via Indicator Spectrometry using Machine-vision) and Machine Learning Modeling of Amide Coupling Reaction},
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  author={Baumer, Mitchell; Gallegos, Liliana C.; Anstine, Dylan M.; Kubaney, Andrew; Regio, Jose Emilio A.; Isayev, Olexander; Bernhard, Stefan; Gomes, Gabe},
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  journal={In preparation},
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  year={2025},
 
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  ```bibtex
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  @article{baumer-gallegos2025prism,
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+ title={Democratizing Reaction Kinetics through Machine Vision and Learning},
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  author={Baumer, Mitchell; Gallegos, Liliana C.; Anstine, Dylan M.; Kubaney, Andrew; Regio, Jose Emilio A.; Isayev, Olexander; Bernhard, Stefan; Gomes, Gabe},
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  journal={In preparation},
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  year={2025},
qm_calculations/README.md CHANGED
@@ -25,14 +25,3 @@ qm_calculations/
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  └── ts/ # Transition state structures (31 files)
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  ```
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- ## Citation
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- If you use this dataset in your research, please cite:
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-
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- ```bibtex
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- @article{baumer-gallegos2025prism,
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- title={PRISM (Parallelized Reaction-rates via Indicator Spectrometry using Machine-vision) and Machine Learning Modeling of Amide Coupling Reaction},
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- author={Baumer, Mitchell; Gallegos, Liliana C.; Anstine, Dylan M.; Kubaney, Andrew; Regio, Jose Emilio A.; Isayev, Olexander; Bernhard, Stefan; Gomes, Gabe},
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- journal={In preparation},
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- year={2025}
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- }
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- ```
 
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  └── ts/ # Transition state structures (31 files)
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  ```
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