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cs.AI2025★ 1 cited
AI-driven ionic liquid discovery with unified chemical intelligence
Yuqi Yin, Yibo Fu, Siyuan Wang +10
The rational discovery of functional solvents remains challenging because macroscopic solvent behaviors emerge from complex many-body interactions across vast chemical spaces. Ioni…
cs.CL2025
Parrot: A Training Pipeline Enhances Both Program CoT and Natural Language CoT for Reasoning
Senjie Jin, Lu Chen, Zhiheng Xi +9
Natural language chain-of-thought (N-CoT) and Program chain-of-thought (P-CoT) have emerged as two primary paradigms for large language models (LLMs) to solve mathematical reasonin…
cs.CL2025
Causal Attention with Lookahead Keys
Zhuoqing Song, Peng Sun, Huizhuo Yuan +1
In standard causal attention, each token's query, key, and value (QKV) are static and encode only preceding context. We introduce CAuSal aTtention with Lookahead kEys (CASTLE), an…