[gmx-users] cosine content

sunita at chem.iitb.ac.in sunita at chem.iitb.ac.in
Thu May 10 09:06:13 CEST 2007


Dear Tsjerk

Thanks for answering last question on finding eigenvectors.

Till now I have not received any answer for the following question.
What do you suggest for this?

Best regards,
Sunita

> Dear users,
>
> I am trying to calculate cosine content of the principal components using
> g_analyze.
>
> I am using time versus projection of trajectory along eigenvector 1
> (extracted from proj.xvg of g_anaeig) as an input file for g_analyze.
> When I calculated the same for eigenvector 2, got memory allocation
> problem.
> How can I fix it?
The second question is, am I doing correctly the calculation of cosine
content?
>
> Regards,
> Sunita
>
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