[gmx-users] g_anaeig error

[Tsjerk Wassenaar]

Hi Tasneem,

Please provide a complete workflow, with commands and selections.

Cheers,

Tsjerk

On Wed, Mar 11, 2015 at 10:31 AM, tasneem kausar <tasneemkausar12 at gmail.com>
wrote:

> for PCA i used the g_covar followed by g_anaeig.
> for g_anaeig i am using the eigenvec.trr file and averagr.pdb file
> these files are generated by g_covar.
> g_anaeig gives the following message;
> There were 40 inconsistent shifts. Check your topology
> where is the problem occured?
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-- 
Tsjerk A. Wassenaar, Ph.D.