VirtuousPocketome: a computational tool for screening protein–ligand complexes to identify similar binding sites
Abstract 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,...
Main Authors: | Lorenzo Pallante, Marco Cannariato, Lampros Androutsos, Eric A. Zizzi, Agorakis Bompotas, Xhesika Hada, Gianvito Grasso, Athanasios Kalogeras, Seferina Mavroudi, Giacomo Di Benedetto, Konstantinos Theofilatos, Marco A. Deriu |
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Format: | Article |
Language: | English |
Published: |
Nature Portfolio
2024-03-01
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Series: | Scientific Reports |
Online Access: | https://doi.org/10.1038/s41598-024-56893-7 |
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