Flying ions

From: jia (
Date: Tue Nov 27 2007 - 21:00:32 CST

Dear all,

During simulations of a globular protein in water, I noticed that the
counterions are flying out of the box after the energy minimization. Is this
normal? Is it possible that the ions could somehow affect the protein
dynamics? Thanks.


Postdoc Research fellow
Center for Molecular Biophysics,
Oak Ridge National Lab
Oak Ridge, TN, 37830

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