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Lv6
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2020 积分
2023-08-24 加入
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Concepts and applications of chemical fingerprint for hit and lead screening
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Challenging Complexity with Simplicity: Rethinking the Role of Single-Step Models in Computer-Aided Synthesis Planning
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SuHAN: Substructural hierarchical attention network for molecular representation
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Few-shot Molecular Property Prediction via Hierarchically Structured Learning on Relation Graphs
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Isotope Effects Reveal the Catalytic Mechanism of the Archetypical Suzuki-Miyaura Reaction
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What is in Our Kit? An Analysis of Building Blocks Used in Medicinal Chemistry Parallel Libraries
10个月前
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