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ResearchFormerly WizWand

Molecular Property Prediction (Regression) on Lipophilicity

0.599RMSEDMMRL
0.459161.403082.3473.29092Feb 23, 2026Mar 17, 2026Apr 9, 2026May 1, 2026May 24, 2026Jun 15, 2026Jul 8, 2026
Updated 4mo ago

Evaluation results

MethodLinks
DMMRL2026.030.599
SGGRL2026.030.617
FP-GNN2026.030.625
MvMRL2026.030.634
GROVER2026.030.643
MPNN2026.030.645
GraSeq2026.030.648
MolCLR2026.070.65
RNN2026.030.77
SciReasoner2026.070.8
GraSPNet2026.020.813
MolCLRGCNModel Type=Graph-based2026.060.819
GROVE2026.020.823
MolCLRGINModel Type=Graph-based2026.060.824
SimSGT2026.020.835
MolCLRCMPNNModel Type=Graph-based2026.060.875
N-Gram2026.030.876
GPT-4oStrategy=+MOLE-RAG2026.060.894
Transformer2026.030.9
SchNetModel Type=Graph-based2026.060.909
SVMCategory=ML Models2026.020.96
GPT-4o-miniStrategy=+MOLE-RAG2026.060.964
Infomax2026.020.97
GROVERModel Type=Graph-based2026.060.974
AttrMasking2026.020.982
GAT + FPCategory=Hybrid (GNN+FP)2026.020.99
XGBoostCategory=ML Models2026.021
GraphCL2026.021.014
GCN + FPCategory=Hybrid (GNN+FP)2026.021.02
GraphSAGE + FPCategory=Hybrid (GNN+FP)2026.021.02
ChemDFM14BStrategy=+MOLE-RAG2026.061.021
GIN + FPCategory=Hybrid (GNN+FP)2026.021.04
ContextPred2026.021.053
EdgePred2026.021.085
JOAO2026.021.093
Qwen34B-InstStrategy=+MOLE-RAG2026.061.105
MGSSL2026.021.106
Random ForestCategory=ML Models2026.021.11
MGCNModel Type=Graph-based2026.061.113
GATCategory=GNN Models2026.021.19
GINCategory=GNN Models2026.021.19
GraphSAGECategory=GNN Models2026.021.19
TrimNet2026.031.202
Mistral7B-InstStrategy=+MOLE-RAG2026.061.21
GCNCategory=GNN Models2026.021.23
GraphFP2026.021.371
GPT-4oStrategy=Baseline2026.061.448
GPT-4o-miniStrategy=Baseline2026.061.667
Llama3.2-3BStrategy=+MOLE-RAG2026.061.706
Linear RegressionCategory=ML Models2026.022.16
ChemDFM14BStrategy=Baseline2026.062.347
Qwen34B-InstStrategy=Baseline2026.062.456
Mistral7B-InstStrategy=Baseline2026.063.347
Llama3.2-3BStrategy=Baseline2026.064.095