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Models/Precursor m/z

Precursor m/z

Reported on 8 benchmarks across 2 tasks · 1 paper

Note: results are matched by exact model name. Different papers may use the same name for different model variants.

Miscellaneous8 results

MS/MS spectrum simulationonMassSpecGym
Cosine Similarity· 2024-10-30
0.15
best: 0.52 (FraGNNet)
MassSpecGym: A benchmark for the discovery and identification of molecules arXiv:2410.23326
MS/MS spectrum simulationonMassSpecGym
Hit Rate @ 1· 2024-10-30
0.38
best: 46.64 (FraGNNet)
MassSpecGym: A benchmark for the discovery and identification of molecules arXiv:2410.23326
MS/MS spectrum simulationonMassSpecGym
Hit Rate @ 20· 2024-10-30
7.17
best: 83.58 (FraGNNet)
MassSpecGym: A benchmark for the discovery and identification of molecules arXiv:2410.23326
MS/MS spectrum simulationonMassSpecGym
Hit Rate @ 5· 2024-10-30
1.72
best: 72.56 (FraGNNet)
MassSpecGym: A benchmark for the discovery and identification of molecules arXiv:2410.23326
MS/MS spectrum simulationonMassSpecGym
Jensen-Shannon Similarity· 2024-10-30
0.15
best: 0.47 (FraGNNet)
MassSpecGym: A benchmark for the discovery and identification of molecules arXiv:2410.23326
MS/MS spectrum simulation (bonus chemical formulae)onMassSpecGym
Hit Rate @ 1· 2024-10-30
2.09
best: 31.93 (FraGNNet)
MassSpecGym: A benchmark for the discovery and identification of molecules arXiv:2410.23326
MS/MS spectrum simulation (bonus chemical formulae)onMassSpecGym
Hit Rate @ 20· 2024-10-30
22.65
best: 82.7 (FraGNNet)
MassSpecGym: A benchmark for the discovery and identification of molecules arXiv:2410.23326
MS/MS spectrum simulation (bonus chemical formulae)onMassSpecGym
Hit Rate @ 5· 2024-10-30
8.52
best: 63.2 (FraGNNet)
MassSpecGym: A benchmark for the discovery and identification of molecules arXiv:2410.23326