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Models/SMA

SMA

Reported on 12 benchmarks across 2 tasks · 1 paper · 4 SOTA

Note: results are matched by exact model name. Different papers may use the same name for different model variants.

Methodology6 results

Molecular Property PredictiononFreeSolv
RMSE· 2024-02-22
1.09
SOTA
Self-Guided Masked Autoencoders for Domain-Agnostic Self-Supervised Learning arXiv:2402.14789
Molecular Property PredictiononLipophilicity
RMSE· 2024-02-22
0.609
best: 0.603 (Uni-Mol)
SOTA
Self-Guided Masked Autoencoders for Domain-Agnostic Self-Supervised Learning arXiv:2402.14789
Molecular Property PredictiononBBBP
ROC-AUC· 2024-02-22
75
best: 96.4 (DumplingGNN)
Self-Guided Masked Autoencoders for Domain-Agnostic Self-Supervised Learning arXiv:2402.14789
Molecular Property PredictiononHIV dataset
AUC· 2024-02-22
0.789
best: 0.81 (DVMP)
Self-Guided Masked Autoencoders for Domain-Agnostic Self-Supervised Learning arXiv:2402.14789
Molecular Property PredictiononBACE
ROC-AUC· 2024-02-22
84.3
best: 88.4 (MolXPT)
Self-Guided Masked Autoencoders for Domain-Agnostic Self-Supervised Learning arXiv:2402.14789
Molecular Property PredictiononESOL
RMSE· 2024-02-22
0.623
best: 0.58 (MPNN)
Self-Guided Masked Autoencoders for Domain-Agnostic Self-Supervised Learning arXiv:2402.14789

Medical6 results

Atomistic DescriptiononFreeSolv
RMSE· 2024-02-22
1.09
SOTA
Self-Guided Masked Autoencoders for Domain-Agnostic Self-Supervised Learning arXiv:2402.14789
Atomistic DescriptiononLipophilicity
RMSE· 2024-02-22
0.609
best: 0.603 (Uni-Mol)
SOTA
Self-Guided Masked Autoencoders for Domain-Agnostic Self-Supervised Learning arXiv:2402.14789
Atomistic DescriptiononBBBP
ROC-AUC· 2024-02-22
75
best: 96.4 (DumplingGNN)
Self-Guided Masked Autoencoders for Domain-Agnostic Self-Supervised Learning arXiv:2402.14789
Atomistic DescriptiononHIV dataset
AUC· 2024-02-22
0.789
best: 0.81 (DVMP)
Self-Guided Masked Autoencoders for Domain-Agnostic Self-Supervised Learning arXiv:2402.14789
Atomistic DescriptiononBACE
ROC-AUC· 2024-02-22
84.3
best: 88.4 (MolXPT)
Self-Guided Masked Autoencoders for Domain-Agnostic Self-Supervised Learning arXiv:2402.14789
Atomistic DescriptiononESOL
RMSE· 2024-02-22
0.623
best: 0.58 (MPNN)
Self-Guided Masked Autoencoders for Domain-Agnostic Self-Supervised Learning arXiv:2402.14789