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QM9 and MD17

The dataset used in this paper is QM9 and MD17, which are computational chemistry datasets.

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Cite this as

Yeskendir Koishekenov, Erik J. Bekkers (2024). Dataset: QM9 and MD17. https://doi.org/10.57702/r5b5hncv

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Additional Info

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Created December 16, 2024
Last update December 16, 2024
Defined In https://doi.org/10.48550/arXiv.2305.01933
Author Yeskendir Koishekenov
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Erik J. Bekkers
Homepage https://doi.org/10.1038/ncomms10657