OmniSyn unifies target-aware molecular generation and optimization within a synthesis-native LLM framework across the human proteome
Qin Zheng, Yuzhang Li, Yueqing Zhang, Yunshuo Zhao, Huan Yee Koh, Zheng Wan, Haocheng Ren, Changying Huang, Yiming Shi, Zhenguo Wu, Yaosen Min, Jing Yang, Xiao He, Duanhua Cao
OmniSyn generates and optimizes target-specific molecules with synthesis traces using a sequence-conditioned LLM, achieving state-of-the-art performance on drug discovery benchmarks.
bioRxiv · Sep 6, 2026 · PreprintBioinformatics