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Incorporating Target Protein Structure Flexibility and Dynamics in Computational Drug Discovery Using Ensemble-Based Docking Analysis
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Incorporating Target Protein Structure Flexibility and Dynamics in Computational Drug Discovery Using Ensemble-Based Docking Analysis

Published on: June 20, 2025

Docking macromolecules with flexible segments

Karine Bastard1, Aurélien Thureau, Richard Lavery

  • 1Laboratoire de Biochimie Théorique, CNRS-UPR 9080, Institut de Biologie Physico-Chimique, 13 rue Pierre et Marie Curie, 75005 Paris, France.

Journal of Computational Chemistry
|September 30, 2003
PubMed

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