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A Multicanonical Study Of The Protein Folding Problem

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  • ULRICH H.E. HANSMANN

    (SCRI, The Florida State University, Tallahassee, FL 32306, USA;
    Dept. of Physical Sciences, Embry-Riddle Aeronautical University, Daytona Beach, FL 32771, USA)

  • YUKO OKAMOTO

    (Dept. of Physics, Nara Women’s University, Nara 630, Japan)

Abstract

Applications of the multicanonical ensemble for the protein folding problem are presented. Performing simulations of this ensemble alleviates the multiple-minima problem and allows to calculate thermodynamical quantities at any temperature from only one Monte Carlo run.

Suggested Citation

  • Ulrich H.E. Hansmann & Yuko Okamoto, 1994. "A Multicanonical Study Of The Protein Folding Problem," International Journal of Modern Physics C (IJMPC), World Scientific Publishing Co. Pte. Ltd., vol. 5(02), pages 271-273.
    • Handle: RePEc:wsi:ijmpcx:v:05:y:1994:i:02:n:s0129183194000301
    DOI: 10.1142/S0129183194000301
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    Cited by:

    1. Menin, Olavo H. & Bauch, Chris T., 2018. "Solving the patient zero inverse problem by using generalized simulated annealing," Physica A: Statistical Mechanics and its Applications, Elsevier, vol. 490(C), pages 1513-1521.

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