On Thu 11 Apr, 2019, 11:15 PM Ali Ahmed, <aa5635...@gmail.com> wrote:
> I see gmx excutable in /usr/local/gromacs/bin/ and I see GMXRC. Yes, each > terminal I run source /usr/local/gromacs/bin/GMXRC to strat using gromacs. > I kind of confused which one I should modify > If that is your executable directory, then there is nothing to modify. What error actually you get? Please try the command gmx_mpi after source command. (A wild guess) Thank you > > On Thu, Apr 11, 2019 at 10:08 AM p buscemi <pbusc...@q.com> wrote: > > > when you open a new terminal you need to run " source" again, but you > > probably know this by now > > or > > add the path to your /etc/.profile to make the change permanent > > > > Sent from Mailspring ( > > > https://link.getmailspring.com/link/1554995165.local-f06b1bee-57af-v1.5.3-420ce...@getmailspring.com/0?redirect=https%3A%2F%2Fgetmailspring.com%2F&recipient=Z214LXVzZXJzQGdyb21hY3Mub3Jn > ), > > the best free email app for work > > On Apr 11 2019, at 1:45 am, Mark Abraham <mark.j.abra...@gmail.com> > wrote: > > > Hi, > > > > > > Each shell you open needs to be told how to find GROMACS, per > > > > > > http://manual.gromacs.org/documentation/current/install-guide/index.html#getting-access-to-gromacs-after-installation > > > > > > Mark > > > On Thu., 11 Apr. 2019, 05:09 Ali Ahmed, <aa5635...@gmail.com> wrote: > > > > Hello GMX users > > > > I have installed gromacs 2019.1 on Ubuntu 16.04 and everything was > > well. > > > > I run: source /usr/local/gromacs/bin/GMXRC and checked the version, > it > > was > > > > 2019.1. > > > > When I open a new terminal and hit gmx, it says gromacs is currently > > not > > > > installed. You can install it by typing: sudo apt install gromacs. > > When I > > > > did it, the version became 5.1.2. > > > > > > > > Any idea how to solve it! > > > > Thank you > > > > Ali > > > > -- > > > > Gromacs Users mailing list > > > > > > > > * Please search the archive at > > > > http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before > > > > posting! > > > > > > > > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists > > > > * For (un)subscribe requests visit > > > > https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users > or > > > > send a mail to gmx-users-requ...@gromacs.org. > > > > > > > -- > > > Gromacs Users mailing list > > > > > > * Please search the archive at > > http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before > > posting! > > > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists > > > * For (un)subscribe requests visit > > > https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or > > send a mail to gmx-users-requ...@gromacs.org. > > > > > > > -- > > Gromacs Users mailing list > > > > * Please search the archive at > > http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before > > posting! > > > > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists > > > > * For (un)subscribe requests visit > > https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or > > send a mail to gmx-users-requ...@gromacs.org. > > > -- > Gromacs Users mailing list > > * Please search the archive at > http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before > posting! > > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists > > * For (un)subscribe requests visit > https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or > send a mail to gmx-users-requ...@gromacs.org. > -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.