Ms Ms Spectrum Simulation Bonus Chemical
评估指标
Hit Rate @ 1
Hit Rate @ 20
Hit Rate @ 5
评测结果
各个模型在此基准测试上的表现结果
模型名称 | Hit Rate @ 1 | Hit Rate @ 20 | Hit Rate @ 5 | Paper Title | Repository |
|---|---|---|---|---|---|
| Precursor m/z | 2.09 | 22.65 | 8.52 | MassSpecGym: A benchmark for the discovery and identification of molecules | |
| FFN Fingerprint | 7.62 | 44.12 | 22.70 | MassSpecGym: A benchmark for the discovery and identification of molecules | |
| FraGNNet | 31.93 | 82.70 | 63.20 | MassSpecGym: A benchmark for the discovery and identification of molecules | |
| GNN | 3.63 | 33.77 | 13.55 | MassSpecGym: A benchmark for the discovery and identification of molecules |
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