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Conformation Reconstruction on NSP Known poses

2.08RMSD (Å)GNN autodecoder
2.03042.36522.73.0348Feb 25, 2026

Evaluation results

MethodLinks
GNN autodecoderR2-regularization=With R2, weights=~150k2026.022.08
MLPR2-regularization=With R2, weights=~150k2026.022.37
GNN autodecoderR2-regularization=Without R2, weights=~150k2026.022.38
MLPR2-regularization=Without R2, weights=~150k2026.023.32