Share your thoughts, 1 month free Claude Pro on us
See more
Home
/
Benchmarks
Unconditional molecule generation on GEOM
Loading...
84.5
Mol Stability Score
MoleculeJAE
2.34
23.67
45
66.33
Dec 6, 2023
Mol Stability Score
Atom Stability
Validity
Uniqueness
AtomTV
BondTV
ValW1 Fidelity
Bond Lengths Fidelity (W1)
Bond Angles Fidelity (W1)
Updated 1mo ago
Evaluation Results
Method
Method
Links
Mol Stability Score
Atom Stability
Validity
Uniqueness
AtomTV
BondTV
ValW1 Fidelity
Bond Lengths Fidelity (W1)
Bond Angles Fidelity (W1)
MoleculeJAE
Pre-training dataset=P...
2023.12
84.5
0.996
0.797
1
0.059
0.021
0.008
0.003
2.16
MiDi
Molecule representatio...
2023.12
69.2
0.99
0.674
1
0.059
0.024
0.036
0.012
5.47
EDM
Epochs=3000
2023.12
5.5
0.929
0.348
1
0.212
0.049
0.112
0.002
6.23
Feedback
Search any
task
Search any
task