jssweller/DrugHIVE

DrugHIVE: Structure-based drug design with a deep hierarchical generative model

⭐ 115 ⑂ 15 Python NOASSERTION · 2024-10-31推送

drug-discovery generative-ai generative-model python pytorch drug-design hierarchical-models ligand-receptor ligand-receptor-interaction protein-structure structure-based structure-based-drug-design

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