GMoLprop
Contents:
GMoLprop: Graph machine learning based molecular property prediction
GMoLprop:
gmolprop
gmolprop.applicability_domain_methods
gmolprop.data_processing
gmolprop.inference
gmolprop.info
gmolprop.models
gmolprop.models.deep_eos_net
gmolprop.models.graph_neural_network
gmolprop.models.graph_neural_network.GNN
gmolprop.models.graph_neural_networkAntoine
gmolprop.powertoys
gmolprop.predict
gmolprop.pyg_molgraph
gmolprop.train_ensemble_model
gmolprop.train_single_model
gmolprop.training
gmolprop.training_type
gmolprop.utils
GMoLprop
gmolprop
gmolprop.models
gmolprop.models.graph_neural_network
gmolprop.models.graph_neural_network
Classes
GNN
Initialization of a GNN.