[gmx-users] is the D G sol of g_sas useless? why?

Mark Abraham Mark.Abraham at anu.edu.au
Thu Aug 27 04:58:11 CEST 2009

Felipe Villanelo wrote:
> Hi gmxs,
> I'm trying to compute a aproximated D G of binding between two proteins
> using a termodynamic cycle, and the D Gsol calculated with g_sas (from 10 ns
> dynamics for every situation)
> But I had read here, that the value this way calculated is useless.... why?

If you read it here, provide us a link :-)


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