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Molecular Property Optimization on Unconstrained Molecular Optimization plogP
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3.405
Mean plogP
HJ
1.66924
2.11987
2.5705
3.02113
May 7, 2024
Mean plogP
Std Dev plogP
Median plogP
Updated 4d ago
Evaluation Results
Method
Method
Links
Mean plogP
Std Dev plogP
Median plogP
HJ
Scenario=Unsupervised...
2024.05
3.405
0.254
3.377
GRADIENT FLOW
Top-K molecules=100
2024.05
2.664
0.382
2.537
CHEMSPACE
Top-K molecules=100
2024.05
2.58
0.406
2.446
WAVE
Scenario=Supervised (S...
2024.05
2.536
0.439
2.388
HJ
Scenario=Supervised (S...
2024.05
2.482
0.397
2.382
LD
Top-K molecules=100
2024.05
2.463
0.388
2.399
RANDOM
Top-K molecules=100
2024.05
2.345
0.386
2.259
WAVE
Scenario=Unsupervised...
2024.05
1.736
0.401
1.61
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