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cs.LG2025
MCCE: A Framework for Multi-LLM Collaborative Search in Discrete Spaces with Similarity-Filtered Preference Learning
Nian Ran, Zhongzheng Li, Yue Wang +5
Multi-objective discrete optimization problems, such as molecular design, pose significant challenges due to their vast and unstructured combinatorial spaces. Traditional evolution…
cs.LG2025★ 2 cited
ExLLM: Experience-Enhanced LLM Optimization for Molecular Design and Beyond
Nian Ran, Yue Wang, Xiaoyuan Zhang +4
Molecular design involves an enormous and irregular search space, where traditional optimizers such as Bayesian optimization, genetic algorithms, and generative models struggle to…