espaloma.nn.readout.janossy

Classes

ExpCoefficients(*args, **kwargs)
JanossyPooling(config, in_features[, ...])	Janossy pooling (arXiv:1811.01900) to average node representation for higher-order nodes.
JanossyPoolingImproper(config, in_features)	Janossy pooling (arXiv:1811.01900) to average node representation for improper torsions.
JanossyPoolingNonbonded(config, in_features)	Janossy pooling (arXiv:1811.01900) to average node representation for nonbonded interactions.
JanossyPoolingWithSmirnoffImproper(config, ...)	Janossy pooling (arXiv:1811.01900) to average node representation for improper torsions.
LinearMixtureToOriginal(*args, **kwargs)