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Catalyst prediction on private dataset
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78.1
Top-1 Similarity
ChemMAS
33.588
45.144
56.7
68.256
Sep 28, 2025
Top-1 Similarity
Top-5 Similarity
Top-10 Similarity
Updated 23d ago
Evaluation Results
Method
Method
Links
Top-1 Similarity
Top-5 Similarity
Top-10 Similarity
ChemMAS
Model Type=Zero-shot LLMs
2025.09
78.1
92.3
96.3
Gemini2.5-Pro
Model Type=Zero-shot LLMs
2025.09
63.4
79.4
80.5
GPT5
Model Type=Zero-shot LLMs
2025.09
62.7
74.2
83.2
Qwen3-235B-A22B
Model Type=Zero-shot LLMs
2025.09
55.4
75.2
77.9
DeepSeek-R1
Model Type=Zero-shot LLMs
2025.09
52.8
69.4
73.2
Claude3.7-Sonnet
Model Type=Zero-shot LLMs
2025.09
43.6
52.9
60.1
MM RCR
Model Type=Pretrained...
2025.09
43.4
60.1
75.9
RCR
Model Type=Pretrained...
2025.09
40.3
52.6
60.7
Reagent Transformer
Model Type=Pretrained...
2025.09
35.3
49.3
56.6
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