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cs.AI2026
Generative structure search for efficient and diverse discovery of molecular and crystal structures
Yifang Qin, Yu Shi, Junfu Tan +3
Predicting stable and metastable structures is central to molecular and materials discovery, but remains limited by the cost of searching high-dimensional energy landscapes. Deep g…
cs.AI2025
Nature Language Model: Deciphering the Language of Nature for Scientific Discovery
Yingce Xia, Peiran Jin, Shufang Xie +43
Foundation models have revolutionized natural language processing and artificial intelligence, significantly enhancing how machines comprehend and generate human languages. Inspire…