[gmx-users] Covariance file format

Tsjerk Wassenaar tsjerkw at gmail.com
Mon Jul 1 07:53:14 CEST 2013

Hi Ankita,

The fie contains the eigenvectors as

x1 y1 z1
x2 y2 z2
xN yN zN

Hope it helps,


On Mon, Jul 1, 2013 at 1:38 AM, Ankita naithani <ankitanaithani at gmail.com>wrote:

> Hi,
> I wanted to know the exact format of covariance.dat file as generated by
> g_covar during covariance analysis. The file format mentioned in the manual
> was not quite clear to understand. I need to use the matrix information n
> so needed to know how the data is stored. My matrix is for 1992 calpha
> atoms.
> It would be really helpful if someone could explain the file format.
> Kind regards,
> Ankita
> --
> Ankita Naithani
> --
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Tsjerk A. Wassenaar, Ph.D.

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