QM7

The Quantum Chemistry dataset contains 7165 molecules. Each molecule is represented by the Coulomb (energy) matrix and its atomization energy.

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The json representation of the dataset with its distributions based on DCAT.
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Ming Lia, Zheng Ma, Yu Guang Wang, Xiaosheng Zhuang (2024). Dataset: QM7. https://doi.org/10.57702/klf8ug6q

DOI retrieved: December 16, 2024

Field	Value
Created	December 16, 2024
Last update	December 16, 2024
Defined In	https://doi.org/10.48550/arXiv.1907.04786
Author	Ming Lia
More Authors	Zheng Ma Yu Guang Wang Xiaosheng Zhuang