"""Best hyperparameters found.""" import torch MWE_GCN_proteins = { 'num_ew_channels': 8, 'num_epochs': 2000, 'in_feats': 1, 'hidden_feats': 10, 'out_feats': 112, 'n_layers': 3, 'lr': 2e-2, 'weight_decay': 0, 'patience': 1000, 'dropout': 0.2, 'aggr_mode': 'sum', ## 'sum' or 'concat' for the aggregation across channels 'ewnorm': 'both' } MWE_DGCN_proteins = { 'num_ew_channels': 8, 'num_epochs': 2000, 'in_feats': 1, 'hidden_feats': 10, 'out_feats': 112, 'n_layers': 2, 'lr': 1e-2, 'weight_decay': 0, 'patience': 300, 'dropout': 0.5, 'aggr_mode': 'sum', 'residual': True, 'ewnorm': 'none' } def get_exp_configure(args): if (args['model'] == 'MWE-GCN'): return MWE_GCN_proteins elif (args['model'] == 'MWE-DGCN'): return MWE_DGCN_proteins