ResearchBenchmarksAbsorption Regression on Caco2 Wang (train-test)Absorption Regression on Caco2 Wang (train-test)Follow0.49RMSEMolFormer0.48320.52910.5750.6209Jun 22, 2026Evaluation resultsMethodMethodLinksRMSEMolFormerPooling=MeanPooling=Mean2026.060.49SAEPooling=MaxPooling=Max2026.060.5SAEPooling=MeanPooling=Mean2026.060.51MolFormerPooling=MaxPooling=Max2026.060.52PcDsDescription=Physicoche...Description=Physicochemical descriptors2026.060.54ECFPRadius=4Radius=42026.060.56ECFPRadius=2Radius=22026.060.59ECFPRadius=0Radius=02026.060.66