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    DFT investigation and molecular dynamic simulation on the selectivecomplexation of cis-cyclic nanopeptides with alkaline earth metalions 

    Type: Journal Paper
    Author : محمّد خوانی صاریانی; محمد ایزدیار; محمدرضا حسین دخت; Mohammad Khavani; Mohammad Izadyar; Mohammad Reza Housaindokht
    Year: 2015
    Abstract:

    Three types of the cyclic peptides constructed of four sequences of glycine

    (CP1) and alanine (CP2) and two sequences of glycine-valine molecules (CP3)

    have been employed for selective complexation with Be2+, ...

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