SMILES-to-Spectra Prediction on SpecMol-Bench IR
0.554Cos SimilaritySpecMol
Evaluation results
| Method | Links | |
|---|---|---|
| SpecMolNumber of Parameters=7B2025.09 | 0.554 | |
| Qwen3Number of Parameters=235B2025.09 | 0.164 | |
| KIMI-K22025.09 | 0.15 | |
| GPT-5-mini2025.09 | 0.149 | |
| Deepseek-V3Number of Parameters=685B2025.09 | 0.14 | |
| o3-mini2025.09 | 0.095 |