Dear Tsjerk sir, I used trjconv -pbc mol -ur compact options.
On Thu, Sep 26, 2013 at 9:17 PM, Tsjerk Wassenaar <tsje...@gmail.com> wrote: > Hi Venkat, > > It depends on what you mean with "removing pbc". > > Cheers, > > Tsjerk > > On Sep 26, 2013 5:21 PM, "Venkat Reddy" <venkat...@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 <vvcha...@gmail.com > >wrote: > > > I do not think that I ever tried myself, but is seems all the same. > Why > do you ask? > > > Dr. V... > -- > gmx-users mailing list gmx-users@gromacs.org > http://lists.gromacs.org/mailman/listinfo/gmx-users > * Please search the archive at > http://www.gromacs.org/Support/Mailing_Lists/Search before posting! > * Please don't post (un)subscribe requests to the list. Use the > www interface or send it to gmx-users-requ...@gromacs.org. > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists > -- With Best Wishes Venkat Reddy Chirasani PhD student Laboratory of Computational Biophysics Department of Biotechnology IIT Madras Chennai INDIA-600036 -- gmx-users mailing list gmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/Search before posting! * Please don't post (un)subscribe requests to the list. Use the www interface or send it to gmx-users-requ...@gromacs.org. * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
