作者位次 #2/4ICLR 2026Poster· Applications / Chemistry and Drug Discovery
GAGA: Gaussianity-Aware Gaussian Approximation for Efficient 3D Molecular Generation
Jingxiang Qu · Wenhan Gao · Ruichen Xu · Yi Liu
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Jingxiang Qu · Wenhan Gao · Ruichen Xu · Yi Liu
Wenhan Gao · Xiran Fan · Chin-Chia Michael Yeh · Jiarui Sun · Yuzhong Chen · Menghai Pan · Mahashweta Das · Yi Liu
The success of large language models (LLMs) across domains highlights their potential in scientific tasks, with molecular optimization being a promising frontier. Traditionally, this optimization relies on iterative expert feedback to refine molecules toward desired properties, a process well ali...