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Updated: Jun 26, 2025

Author Spotlight: Streamlining Protein Target Prediction and Validation via Molecular Docking and CETSA
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绑定SiteDTI:用于药物向相互作用预测的差异尺度绑定位点建模

Feng Pan1, Chong Yin1, Si-Qi Liu1,2

  • 1Department of Computer Science, Hong Kong Baptist University, Kowloon, 999077, Hong Kong.

Bioinformatics (Oxford, England)
|May 11, 2024
PubMed
概括

本研究介绍了BindingSiteDTI,这是一个用于药物向相互作用 (DTI) 预测的新型深度学习网络. 它有效地模拟分子差异,以提高药物发现的准确性.

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Conserved Binding Sites01:49

Conserved Binding Sites

Many proteins’ biological role depends on their interactions with their ligands, small molecules that bind to specific locations on the protein known as ligand-binding sites. Ligand-binding sites are often conserved among homologous proteins as these sites are critical for protein function.
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