Pocket to concavity: a tool for the refinement of protein-ligand binding site shape from alpha spheres

SUMMARY: Understanding the binding site of the target protein is essential for rational drug design. Pocket detection software predicts the ligand binding site of the target protein; however, the predicted protein pockets are often excessively estimated in comparison with the actual volume of the bo...

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Bibliographic Details
Main Authors: Hirao, T. (Author), Hirokawa, T. (Author), Kudo, G. (Author), Shigeta, Y. (Author), Yoshino, R. (Author)
Format: Article
Language:English
Published: NLM (Medline) 2023
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