Current computer-aided drug design
Drug-target Affinity Prediction Based on Graph Transformer and Selfattention Mechanism Kinase-specific Drug-target Affinity Prediction with Graph Transformer and Self-Attention Fusion.
Shiqian Han, Jiahao Shi, Jun Wang
Published: 202610.2174/0115734099414256251122113126
Abstract
INTRODUCTION/OBJECTIVE: Traditional drug discovery methods face efficiency bottlenecks in predicting drug-target binding affinity (DTA), particularly for kinase inhibitor screening. This study proposes GTDDTA-a novel deep learning framework based on…
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