Yan Yan Xu on Muck Rack

Yan Yan Xu

As seen in: Cell Press, World Journal 世界日報
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Articles

Unified modeling of 3D molecular generation via atomic interactions with PocketXMol

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By Xingang Peng, Ruihan Guo, Fenglin Guo, Ziyi WANG, Jiayu Sun, Jiaqi Guan, Yinjun Jia, Yan Yan Xu, Yanwen Huang, Muhan Zhang, Jian Peng, Xinquan Wang, Chuanhui Han, Zihua Wang, Jianzhu Ma
| Cell Press
Keywords molecular interaction generative model unified AI model molecular structure prediction peptide design drug design molecular docking protein pocket atom-level interaction foundation model Introduction Artificial intelligence (AI) has revolutionized molecular structure prediction1,2,3,4 and design,5,6,7,8,9 yet current models typically rely on specialized algorithms tailored to specific tasks.
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