SquareHK/THEMol download history

SquareHK/THEMol is a dataset on the Hugging Face Hub. In the last 30 days it was downloaded 1,590 times (281 in the last 7 days), and 8,678 times in total. It ranks #13,538 among datasets by monthly downloads.

THEMol: Torsion, Hessian, Energy of Molecules Dataset Summary THEMol is an open-source collection of quantum mechanical properties tailored for organic molecules. It provides large-scale density functional theory (DFT) data for exploring intramolecular potential energy surfaces

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