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Benchmarks
Conditional Molecular Generation (mu) on QM9 (test)
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0.043
MAE
L-bound
-1.02144
6.16353
13.3485
20.53347
Nov 1, 2024
MAE
MS
Validity
Updated 4d ago
Evaluation Results
Method
Method
Links
MAE
MS
Validity
L-bound
2024.11
0.043
-
-
TACS
2024.11
0.387
83.3
91.3
EEGSDE
2024.11
0.854
79.4
90.6
TCS
2024.11
0.971
92.7
96.6
EDM
2024.11
1.118
80.8
91.2
U-bound
2024.11
1.613
-
-
OG
mode=online guidance
2024.11
26.654
6.8
29.7
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