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    Metal-Organic Frameworks as drug delivery systems: The case of IRMOF-74-III and gemcitabine studied by MD simulations 

    Cournia, Zoe; Galdadas, Ioannis (BRFAA, 2017-04-27)
    A multiscale computational study is reported that investigates the microscopic behavior of the anti-cancer drug gemcitabine (GEM) stored in metal organic frameworks IRMOF-74-III and the functionalized OH-IRMOF-74-III. ...

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    Author
    Cournia, Zoe (1)
    Galdadas, Ioannis (1)
    Subject
    cancer, gemcitabine, Molecular Dynamics simulations, MOF, GROMACS, drug (1)
    ... View MoreDate Issued2017 (1)

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