On Mon, Aug 24, 2009, E.M. wrote:
> What does GMAX in minimization output stand for?. Also, when the RMS is
> reported, is this taken between alpha carbons of subsequent outputs or
> how is this made?. I just do not know the code, so I do not know what is
> reporting. :/
GMAX is the element of the gradient vector with the largest magnitude. RMS is
the root-mean-square of the gradient vector (has nothing to do with
coordinates.)
...dac
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Received on Mon Aug 24 2009 - 11:11:24 PDT
