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Structural Accuracy Evaluation on TRPcage

0.88GDT-TSAll-Atom
0.63040.69520.760.8248Feb 13, 2026

Evaluation results

MethodLinks
All-AtomCategory=Reference2026.020.880.95
FlashSchNetCategory=MLFF2026.020.720.89
CGSchNetCategory=MLFF2026.020.720.96
MARTINICategory=Classical2026.020.640.6