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cs.AI2026
DN-Hypo-Pipeline: An AI-Driven Workflow for Generating Hypotheses using Large Language Models and Scientific Explanations
Lei Lin, Xinlong Pan, Ronghao Wang +4
Modern artificial intelligence excels at prediction but cannot explain. From large language models to AI-for-science systems, today's machines answer what by recombining patterns a…
cs.AI2024
UniIF: Unified Molecule Inverse Folding
Zhangyang Gao, Jue Wang, Cheng Tan +5
Molecule inverse folding has been a long-standing challenge in chemistry and biology, with the potential to revolutionize drug discovery and material science. Despite specified mod…