API Reference

The “gp” module

mff.gp.GaussianProcess

The “configurations” module

mff.configurations.Configurations

The “calculators” module

mff.calculators.TwoBodySingleSpecies

mff.calculators.TwoBodyTwoSpecies

mff.calculators.ThreeBodySingleSpecies

mff.calculators.ThreeBodyTwoSpecies

mff.calculators.CombinedSingleSpecies

mff.calculators.CombinedTwoSpecies

The “advanced_sampling” module

mff.advanced_sampling