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A Review of Current Computational Tools for Peptide-Protein Docking

Fábio G Martins1, Hélder A Santos2, Sérgio F Sousa1,3

  • 1Department of Biomedicine, Faculty of Medicine, LAQV/REQUIMTE, BioSIM, University of Porto, Porto, Portugal.

Journal of Computational Chemistry
|February 13, 2026
PubMed

Keywords:
drug discoverymolecular dockingmolecular modelingpeptide therapeuticspeptidespeptide‐protein dockingprotein‐ligand modelingstructure‐based drug design

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