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Updated: Feb 23, 2026

Incorporating Target Protein Structure Flexibility and Dynamics in Computational Drug Discovery Using Ensemble-Based Docking Analysis
Published on: June 20, 2025
Michael Estrin1, Haim J Wolfson1
1Blavatnik School of Computer Science, Tel Aviv University, Tel Aviv, Israel.
SnapDock, a template-based protein-protein docking algorithm, achieves 35% success in re-modeling PDB complexes. Combining it with PatchDock boosts success to 42%, offering an efficient approach for protein interaction studies.
05:08Application of I TASSER, trRosetta, UCSF Chimera, HADDOCK server, and HEX loria for De Novo and In Silico Design of Proteins
Published on: July 8, 2025
10:21Author Spotlight: Streamlining Protein Target Prediction and Validation via Molecular Docking and CETSA
Published on: February 23, 2024
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