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Updated: Feb 16, 2026

Incorporating Target Protein Structure Flexibility and Dynamics in Computational Drug Discovery Using Ensemble-Based Docking Analysis
Published on: June 20, 2025
Chris Fotis1, Asier Antoranz2, Dimitris Hatziavramidis1
1National Technical University of Athens, Athens, Greece.
New computational tools enhance traditional drug discovery by integrating systems biology and omics technologies. This holistic approach aids in identifying promising drug targets and compounds for diseases.
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