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Mapping Non-Homologous Pocket Compatibilities to Identify Hidden Drug-Target Relationships: A Pocket Hopping Framework
16小时前
待确认
ECloudGen: leveraging electron clouds as a latent variable to scale up structure-based molecular design
8个月前
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Electron-density informed effective and reliable de novo molecular design and lead optimization with ED2Mol
10个月前
已完结
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