ResearchBenchmarksAbsorption Regression on Lipophilicity AstraZeneca (train test)Follow0.75RMSESAE0.73560.83280.931.0272Jun 22, 2026Evaluation ResultsMethodMethodLinksRMSESAEPooling=MeanPooling=Mean2026.060.75SAEPooling=MaxPooling=Max2026.060.75MolFormerPooling=MeanPooling=Mean2026.060.78ECFPRadius=2Radius=22026.060.81MolFormerPooling=MaxPooling=Max2026.060.81ECFPRadius=4Radius=42026.060.85PcDsDescription=Physicoche...Description=Physicochemical descriptors2026.061.03ECFPRadius=0Radius=02026.061.11