Article

VirtuousPocketome: A Computational Tool for Screening Protein-ligand Complexes to Identify Similar Binding Sites

2023-12-13

Abstract excerpt

<h4>ABSTRACT</h4> Protein residues within binding pockets play a critical role in determining the range of ligands that can interact with a protein, influencing its structure and function. Identifying structural similarities in proteins offers valuable insights into their function and activation mechanisms, aiding in predicting protein-ligand interactions, anticipating off-target effects, and facilitating the dev...

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Literature Corpus work: e91330e9-5ff3-5a9f-88bd-fad8bd4b3120
DOI: 10.1101/2023.12.12.571207

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