Quantum Chemical Property Prediction on QM9 Strict OOD
0.1621HOMO Energy (eV)ViSNet
Evaluation Results
| Method | Links | |||
|---|---|---|---|---|
| ViSNetAdaptation Protocol=Supervised baseline, Backbone=ViSNet2026.05 | 0.1621 | 0.1829 | 0.2303 | |
| GotenNetAdaptation Protocol=Supervised baseline, Backbone=GotenNet2026.05 | 0.158 | 0.1902 | 0.2059 | |
| POMAAdaptation Protocol=+POMA, Backbone=ViSNet2026.05 | 0.154 | 0.1673 | 0.227 | |
| POMAAdaptation Protocol=+POMA, Backbone=GotenNet2026.05 | 0.1535 | 0.1728 | 0.2021 | |
| ETNNAdaptation Protocol=Supervised baseline, Backbone=ETNN2026.05 | 0.1349 | 0.1312 | 0.1814 | |
| POMAAdaptation Protocol=+POMA, Backbone=ETNN2026.05 | 0.1233 | 0.1165 | 0.1681 |