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Molecular Property Prediction (LUMO) on QM9 (test)

29.8MAESE(3)
29.25232.95136.6540.349Jun 4, 2025

Evaluation results

MethodLinks
SE(3)Augmentation Strategy=Oracle augmentation (ground-truth rigid-motion symmetry)2025.0629.8
LieAugmenterAugmentation Strategy=Symmetry discovery2025.0630.7
AugerinoAugmentation Strategy=Symmetry discovery2025.0633.7
LieGANAugmentation Strategy=Symmetry discovery2025.0636.4
TrivialAugmentation Strategy=No augmentation2025.0643.5