A deep learning approach for rational ligand generation with toxicity control via reactive building blocks - researchr publication

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Pengyong Li, Kaihao Zhang, Tianxiao Liu, Ruiqiang Lu, Yangyang Chen 0006, Xiaojun Yao, Lin Gao, Xiangxiang Zeng. A deep learning approach for rational ligand generation with toxicity control via reactive building blocks. Nat. Comput. Sci., 4(11):851-864, November 2024. [doi]

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runs on WebDSL