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Benchmarks
De Novo Generation on MPTS-52 (test)
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99.87
Structural Validity
DiffCSP++
66.174
74.922
83.67
92.418
Feb 23, 2026
Structural Validity
Compositional Validity
Updated 4d ago
Evaluation Results
Method
Method
Links
Structural Validity
Compositional Validity
DiffCSP++
2026.02
99.87
77.52
MCFlow-B
Model Size=Base
2026.02
98.34
85.57
SGEquiDiff
2026.02
97.79
79.83
MCFlow-L
Model Size=Large
2026.02
97.34
85.21
MCFlow-S
Model Size=Small
2026.02
96.73
84.62
SymmCD
2026.02
87.11
78.18
DiffCSP
2026.02
67.47
55.8
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