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Retrosynthesis on mkt-lin-500
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100
Tier-0 Validity
AiZynthFinder MCTS
95
97.5
100
102.5
Jun 23, 2026
Tier-0 Validity
Solution Success Rate (Zero-Shot)
Top-1 Accuracy
Top-10 Accuracy
Top-10 Accuracy (CI Lower Bound)
Root Top-10 Accuracy
Route Accuracy (Root Top-10)
Prediction Time (Mixed Units)
Updated 1mo ago
Evaluation Results
Method
Method
Links
Tier-0 Validity
Solution Success Rate (Zero-Shot)
Top-1 Accuracy
Top-10 Accuracy
Top-10 Accuracy (CI Lower Bound)
Root Top-10 Accuracy
Route Accuracy (Root Top-10)
Prediction Time (Mixed Units)
AiZynthFinder MCTS
Training dataset=v2026...
2026.06
100
92.4
17.2
30.6
26.6
56.6
54.1
48.4
Ariadne 24L
Training dataset=v2026...
2026.06
100
90.4
18.8
37.2
33
63
59
1
AiZynthFinder MCTS
Training dataset=v2026...
2026.06
100
92.6
18.6
33.6
29.4
58.8
57.1
48.1
Ariadne 24L
Training dataset=v2026...
2026.06
100
96.4
29.4
52.6
48.2
72.4
72.7
1.1
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