ResearchBenchmarksStructure-to-Structure Prediction on TG80 UMAP clusters (Out-of-Domain)Structure-to-Structure Prediction on TG80 UMAP clusters (Out-of-Domain)Follow0.4197S2S MSE (Cluster 1)ATOM0.4153280.4448390.474350.503861Oct 7, 2025Evaluation resultsMethodMethodLinksS2S MSE (Cluster 1)S2S MSE (Cluster 2)S2S MSE (Cluster 3)S2S MSE (Cluster 4)S2S MSE (Cluster 5)ATOM2025.100.41971.27950.74530.80950.5826EGNN-R2025.100.52081.08891.48671.63271.0994EGNN-S2025.100.5239165.12071.49416.63541.1108EGNO2025.100.5291.14141.49991.63471.1236