Re: Coarse Grain of a Calcium Binding Protein

From: Ajasja Ljubetič (ajasja.ljubetic_at_gmail.com)
Date: Wed Aug 09 2017 - 10:51:34 CDT

Hi,

be warned that doubly charged ions are difficult to parametrize even with
all-atom MD.
In coarse graining this will probably be even more problematic
<http://www.cgmartini.nl/index.php/component/kunena/16-other-molecules/372-calcium-parameters-for-cg-model-for-protein>

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