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    Please use this identifier to cite or link to this item: http://ir.lib.ncu.edu.tw/handle/987654321/51071

    Title: From laws of inference to protein folding dynamics
    Authors: Tseng,CY;Yu,CP;Lee,HC
    Contributors: 系統生物與生物資訊研究所
    Date: 2010
    Issue Date: 2012-03-27 18:20:31 (UTC+8)
    Publisher: 國立中央大學
    Abstract: Protein folding dynamics is one of major issues constantly investigated in the study of protein functions. The molecular dynamic (MD) simulation with the replica exchange method (REM) is a common theoretical approach considered. Yet a trade-off in applying the REM is that the dynamics toward the native configuration in the simulations seems lost. In this work, we show that given REM-MD simulation results, protein folding dynamics can be directly derived from laws of inference. The applicability of the resulting approach, the entropic folding dynamics, is illustrated by investigating a well-studied Trp-cage peptide. Our results are qualitatively comparable with those from other studies. The current studies suggest that the incorporation of laws of inference and physics brings in a comprehensive perspective on exploring the protein folding dynamics.
    Appears in Collections:[系統生物與生物資訊研究所] 期刊論文

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