Dataset Groups Activity Stream QM7b dataset A dataset of 6868 molecules from the QM7b dataset that contains only CHNO atoms. BibTex: @dataset{Jigyasa_Nigam_and_Michael_J_Willatt_and_Michele_Ceriotti_2025, abstract = {A dataset of 6868 molecules from the QM7b dataset that contains only CHNO atoms.}, author = {Jigyasa Nigam and Michael J. Willatt and Michele Ceriotti}, doi = {10.57702/ab6gzney}, institution = {No Organization}, keyword = {'Machine Learning', 'QM7b', 'Quantum Chemistry'}, month = {jan}, publisher = {TIB}, title = {QM7b dataset}, url = {https://service.tib.eu/ldmservice/dataset/qm7b-dataset}, year = {2025} }
