Sequence-based virtual screening using transformers

Abstract Protein-ligand interactions play central roles in myriad biological processes and are of key importance in drug design. Deep learning approaches are becoming cost-effective alternatives to high-throughput experimental methods for ligand identification. Here, to predict the binding affinity...

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Bibliographic Details
Main Authors: Shengyu Zhang, Donghui Huo, Robert I. Horne, Yumeng Qi, Sebastian Pujalte Ojeda, Aixia Yan, Michele Vendruscolo
Format: Article
Language:English
Published: Nature Portfolio 2025-07-01
Series:Nature Communications
Online Access:https://doi.org/10.1038/s41467-025-61833-8
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