MS/MS spectrum simulation on MassSpecGym

Metric: Hit Rate @ 1 (higher is better)

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#	Model↕	Hit Rate @ 1▼	Extra Data	Paper	Date↕	Code
1	FraGNNet	46.64	No	MassSpecGym: A benchmark for the discovery and i...	2024-10-30	Code
2	FFN Fingerprint	8.44	No	MassSpecGym: A benchmark for the discovery and i...	2024-10-30	Code
3	GNN	3.95	No	MassSpecGym: A benchmark for the discovery and i...	2024-10-30	Code
4	Precursor m/z	0.38	No	MassSpecGym: A benchmark for the discovery and i...	2024-10-30	Code

#1FraGNNetSOTA
46.64
Hit Rate @ 1· 2024-10-30
MassSpecGym: A benchmark for the discovery and identification of molecules Code
#2FFN Fingerprint
8.44
Hit Rate @ 1· 2024-10-30
MassSpecGym: A benchmark for the discovery and identification of molecules Code
#3GNN
3.95
Hit Rate @ 1· 2024-10-30
MassSpecGym: A benchmark for the discovery and identification of molecules Code
#4Precursor m/z
0.38
Hit Rate @ 1· 2024-10-30
MassSpecGym: A benchmark for the discovery and identification of molecules Code