Dear Sir, Thank you It worked :). a very usefull suggestion. But it did not promt to choose any option. I used index file.
Thank you Kavya On Thu, Jul 12, 2012 at 6:02 PM, Justin A. Lemkul <jalem...@vt.edu> wrote: > > > On 7/12/12 8:31 AM, Kavyashree M wrote: >> >> Ok may be i need to specify an index file. I will try that. >> And regarding the WARNING: this .tpx file is not fully functional. >> I hope it will work fine enough to finish g_saltbr calculation? >> > > In principle, you should be prompted to choose a default group, but you can > also use a custom index group as needed. > > The warning message is intended to note that the .tpr file you produce will > not likely work for running an actual simulation. It should be fine for > analysis. > > > -Justin > > -- > ======================================== > > Justin A. Lemkul, Ph.D. > Research Scientist > Department of Biochemistry > Virginia Tech > Blacksburg, VA > jalemkul[at]vt.edu | (540) 231-9080 > http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin > > ======================================== > > > -- > gmx-users mailing list gmx-users@gromacs.org > http://lists.gromacs.org/mailman/listinfo/gmx-users > * Only plain text messages are allowed! > * 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 -- gmx-users mailing list gmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users * Only plain text messages are allowed! * 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
