Spice: A dataset of drug-like molecules and peptides for ML potentials
Published in Scientific Data, 2023
Recommended citation: Eastman, P., Behara, P. K., Dotson, D. L., Galvelis, R., Herr, J. E., et al. Scientific Data 2023, 10, 11.
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Published in Scientific Data, 2023
Recommended citation: Eastman, P., Behara, P. K., Dotson, D. L., Galvelis, R., Herr, J. E., et al. Scientific Data 2023, 10, 11.
Download Paper