Spectral prediction on NIST [M+H]+ adduct '20 (Scaffold split)
78.8Cosine SimilarityGLACIER
Evaluation results
| Method | Links | |||
|---|---|---|---|---|
| GLACIERConditioning=w/o CF2026.06 | 78.8 | 73.3 | 87.6 | |
| GLACIERConditioning=w/ CF2026.06 | 76.3 | 69.7 | 84 | |
| ICEBERG 2.02026.06 | 73.5 | 70.8 | 84.7 | |
| ICEBERG2026.06 | 70.1 | 64.1 | 79 | |
| FraGNNet2026.06 | 65.4 | — | — | |
| MassFormer2026.06 | 52.6 | 51.2 | 74.2 | |
| GrAFF-MS2026.06 | 47 | 44.8 | 70.6 | |
| CFM-ID2026.06 | 45 | 40.1 | 22.8 |