Design Example: Traverse Angle Computations
Combinatorial Gene Control
Structural Protein Function
Structural Protein Function
Protein and Protein Structure
Mechanical Protein Functions
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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
Seung-gu Kang1, Jeffery G Saven
1Department of Chemistry, University of Pennsylvania, 231 South 34th Street, Philadelphia, PA 19104, USA.
Computational protein design methods have advanced, enabling the creation of novel proteins with specific structures, sequences, and functions. Applications include designing new proteins, incorporating non-biological parts, and building protein libraries.
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