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simonaxelrod authored Dec 2, 2020
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Expand Up @@ -67,5 +67,5 @@ We have updated the GEOM dataset since our paper was first posted on the ArXiv,


## Training machine learning models
To train conformer-based machine learning models on the GEOM data, you can use the [Neural Force Field](https://github.com/learningmatter-mit/NeuralForceField) repository. In particular, you can navigate to the Cp3D tutorial to see how the models get created and trained, or `scripts/cp3d` to learn how to run training scripts.
To train conformer-based machine learning models on the GEOM data, you can use the [Neural Force Field](https://github.com/learningmatter-mit/NeuralForceField) repository. In particular, you can navigate to the Cp3D tutorial to see how the models get created and trained, or to `scripts/cp3d` to learn how to run training scripts.

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