schnetpack.datasets

Molecules

`QM9`	QM9 benchmark database for organic molecules.
`MD17`	MD17 benchmark data set for molecular dynamics of small molecules containing molecular forces.
`ANI1`	ANI1 benchmark database.
`ISO17`	ISO17 benchmark data set for molecular dynamics of C7O2H10 isomers containing molecular forces.

`MaterialsProject`	Materials Project (MP) database of bulk crystals.
`OrganicMaterialsDatabase`	Organic Materials Database (OMDB) of bulk organic crystals.