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A competitive Brownian model for the interaction of ferredoxin, ferredoxin NADP+ reductase and hydrogenase has been built. In the model, molecules of three types of proteins are placed into a cubic reaction volume, where they move under Brownian and electrostatic forces created by neighboring molecules and the solution. It has been shown that the rate of ferredoxin binding with ferredoxin NADP+ reductase...
The application of Brownian dynamics for simulation of transient protein–protein interactions is reviewed. The review focuses on the theoretical basics of the Brownian-dynamics method, its particular implementations, and the advantages and drawbacks of this method. The outlook for future development of Brownian dynamics-based simulation techniques is discussed. Special attention is given to analysis...
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