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Computer Simulation Of Biological Macromolecules In Generalized Ensembles

Author

Listed:
  • ULRICH H. E. HANSMANN

    (Dept. of Physics, Michigan Technological University, Houghton, Michigan 49931-1295, USA)

Abstract

For many years the emphasis in protein-folding simulations has been laid as to how to predict the three-dimensional structure of proteins. Only recently has there be a shift in interest towards the thermodynamics of folding. We show that generalized-ensemble techniques are well suited to study both questions for realistic protein models.

Suggested Citation

  • Ulrich H. E. Hansmann, 1999. "Computer Simulation Of Biological Macromolecules In Generalized Ensembles," International Journal of Modern Physics C (IJMPC), World Scientific Publishing Co. Pte. Ltd., vol. 10(08), pages 1521-1530.
    • Handle: RePEc:wsi:ijmpcx:v:10:y:1999:i:08:n:s0129183199001303
    DOI: 10.1142/S0129183199001303
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