QM7-X: A comprehensive dataset of quantum-mechanical properties spanning the chemical space of small organic molecules

Johannes Hoja(University of Graz), Alexandre Tkatchenko(University of Luxembourg), Robert A. DiStasio(Princeton University), Brian G. Ernst(Cornell University), Álvaro Vázquez‐Mayagoitia(Argonne National Laboratory), Leonardo Medrano Sandonas(University of Luxembourg)
Open Repository and Bibliography (University of Luxembourg)
June 26, 2020
Cited by 122


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