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colabfit/
ANI-1xBB

interatomic potential

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	Cite this dataset Zhang, S., Zubatyuk, R., Yang, Y., Roitberg, A., and Isayev, O. ANI-1xBB. ColabFit, 2025. https://doi.org/None




	
	This dataset has been curated and formatted for the ColabFit Exchange




	
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https://materials.colabfit.org/id/DS_psm97yt0sles_0

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https://materials.colabfit.org… See the full description on the dataset page: https://huggingface.co/datasets/colabfit/ANI-1xBB.