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Chapters
- 00:04Introduction
- 01:05System Preparation
- 02:25Energy Minimization
- 03:16Heating, Equilibration, and Production Dynamics
- 04:36Results: Biomolecular Simulation of the Wild-Type Caspase and its Mutant Form
- 05:27Conclusion
The present protocol uses a biomolecular simulation package and describes the molecular dynamics (MD) approach for modeling the wild-type caspase and its mutant forms. The MD method allows for assessing the dynamic evolution of the caspase structure and the potential effect of mutations or post-translational modifications.
