Hello,
I would like to ask if the SCC-DFTB method for hybrid QM/MM
simulations within the Amber Molecular Dynamics Package has been
parametrized for mercury ions (Hg2+) in proteins?
Thank you very much for your attention and looking forward to hear from you.
Vaida Arcisauskaite
PhD student at LIFE faculty
University of Copenhagen
Denmark
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Received on Wed Sep 02 2009 - 23:05:44 PDT
