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Benchmarks
Molecular Generation on QM9 (Validity, Uniqueness, FCD, NSPDK)
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99.76
Validity
GVT
55.456
66.958
78.46
89.962
Dec 2, 2025
Validity
Uniqueness
FCD
NSPDK
Updated 1mo ago
Evaluation Results
Method
Method
Links
Validity
Uniqueness
FCD
NSPDK
GVT
Class=VQVAE+AR
2025.12
99.76
95.94
0.87
0.0006
SwinGNN
Class=Diffusion
2025.12
99.68
95.92
0.169
0.0004
PARD
Class=Hybrid
2025.12
97.5
95.8
-
-
GLAD
Class=Diffusion
2025.12
97.12
97.52
0.201
0.0003
DiGress
Class=Diffusion
2025.12
95.43
93.78
0.643
0.0007
DGAE
Class=Hybrid
2025.12
92
97.61
0.86
0.0015
GDSS
Class=Diffusion
2025.12
90.36
94.7
2.923
0.0044
GraphDF
Class=Flow-Based
2025.12
79.33
95.73
11.283
0.075
GraphAF
Class=Flow-Based
2025.12
57.16
83.78
5.384
0.021
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