[gmx-users] trjcat after trjconv

Tsjerk Wassenaar tsjerkw at gmail.com
Thu Sep 26 17:47:47 CEST 2013


Hi Venkat,

It depends on what you mean with "removing pbc".

Cheers,

Tsjerk

On Sep 26, 2013 5:21 PM, "Venkat Reddy" <venkat4bt at gmail.com> wrote:

Dear Sir,
Thanks for the quick reply.
I accidentally lost one of my raw .xtc files. But I have the noPBC xtc
file. So, when ever I extend my simulation, first I am removing PBC then
concatenating it with existing noPBC xtc file. Is it fine??


On Thu, Sep 26, 2013 at 7:13 PM, Dr. Vitaly Chaban <vvchaban at gmail.com
>wrote:

> I do not think that I ever tried myself, but is seems all the same. > Why
do you ask? > > > Dr. V...



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