ECD Spectrum Prediction on ACMP (test)
2.89Position RMSEChiGNN
Evaluation results
| Method | Links | |||
|---|---|---|---|---|
| ChiGNN2026.02 | 2.89 | 1.06 | 0.508 | |
| Tetra-DMPNNvariant=canonical2026.02 | 3.15 | 1.2 | 0.528 | |
| Tetra-DMPNNvariant=permute2026.02 | 3.16 | 1.05 | 0.528 | |
| ChiDeK2026.02 | 3.24 | 1.05 | 0.712 | |
| SphereNet2026.02 | 3.36 | 1.08 | 0.524 | |
| DimeNet++2026.02 | 3.62 | 1.13 | 0.5 | |
| SPMS2026.02 | 3.69 | 1.16 | 0.604 | |
| ChIRo2026.02 | 3.78 | 1.11 | 0.511 | |
| ECDFormer2026.02 | 3.89 | 1.16 | 0.515 |