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Protein WISDOM: A Workbench for In silico De novo Design of BioMolecules
Published on: July 25, 2013
Heuristic algorithms in evolutionary computation and modular organization of biological macromolecules: Applications
Alexander V Spirov1,2, Ekaterina M Myasnikova3
1I. M. Sechenov Institute of Evolutionary Physiology and Biochemistry Russian Academy of Sciences, St. Petersburg, Russia.
Evolutionary computing methods can accelerate in vitro evolution experiments. By adapting genetic algorithm building block concepts to biological systems, researchers can enhance directed evolution efficiency for macromolecules.
Area of Science:
- Computer Science and Applied Mathematics
- Synthetic Biology
- Biotechnology
Background:
- Evolutionary computing (EC) utilizes nature-inspired optimization algorithms.
- EC methods, particularly genetic algorithms (GA), excel at identifying and combining 'building blocks' (BBs) for efficient search.
- In vitro evolution of biological macromolecules presents challenges analogous to EC search problems.
Purpose of the Study:
- To explore the application of EC principles to in vitro evolution.
- To adapt EC's 'building block' concept for directed evolution of biological macromolecules.
- To develop novel fitness functions and algorithms for enhanced in vitro evolution.
Main Methods:
- Extension of John Holland's Royal Roads fitness function to create Biological Royal Staircase (BioRS) functions.
- Development of heuristic algorithms inspired by EC's building block preservation strategies.
- Numerical testing of BioRS functions with heuristic algorithms for aptazyme evolution.
Main Results:
- BioRS functions effectively model in vitro evolution challenges for RNA-devices.
- Simple heuristic algorithms demonstrated high efficacy in preserving building blocks within BioRS.
- These algorithms proved highly effective for in vitro evolution approaches.
Conclusions:
- EC methods, especially those preserving building blocks, are suitable for in vitro evolution.
- The developed BioRS functions and heuristic algorithms can significantly improve efficiency.
- Implementation of these EC-inspired methods promises substantial time and resource savings in directed evolution experiments.
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