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Benchmarks
Molecular Generation on L1000 Bulk Out-of-Distribution - Unseen Drugs
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90.9
Coverage
CURE
43.632
55.9035
68.175
80.4465
May 14, 2026
Coverage
Unique
Similarity
Distance
QED
Fraggle Sim.
Morgan Sim.
PRnet MSE
Updated 16d ago
Evaluation Results
Method
Method
Links
Coverage
Unique
Similarity
Distance
QED
Fraggle Sim.
Morgan Sim.
PRnet MSE
CURE
Data Type=Bulk, Split=...
2026.05
90.9
90.18
95.76
9.5265
57.25
85.92
77.22
0.4866
TRIOMPHE
Data Type=Bulk, Split=...
2026.05
63.64
88.29
73.24
54.3125
35.89
57.04
50.81
7.4666
GexMolGen
Data Type=Bulk, Split=...
2026.05
54.55
76.09
90.13
40.0122
50.98
71.94
69.03
5.0482
Gx2Mol
Data Type=Bulk, Split=...
2026.05
45.45
72.8
71.06
64.6032
62.32
61.13
58.82
2.7208
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