Re: [gmx-users] Problems with IMD in Gromacs 2016.3

2017-06-15 Thread Mark Abraham
Hi, Those are freely available to register, though I don't have a link to hand. Mark On Fri, 16 Jun 2017 00:58 Charles Laughton < charles.laugh...@nottingham.ac.uk> wrote: > Hi Mark, > > Redmine.gromacs.org asks me for a username and password – I have neither. > > Regards, > > Charlie > > > On

Re: [gmx-users] Problems with IMD in Gromacs 2016.3

2017-06-15 Thread Charles Laughton
Hi Mark, Redmine.gromacs.org asks me for a username and password – I have neither. Regards, Charlie On 15/06/2017, 19:10, "gromacs.org_gmx-users-boun...@maillist.sys.kth.se on behalf of Mark Abraham" wrote: Redmine.gromacs.org This message and any attachment are intended solely for

Re: [gmx-users] Problems with IMD in Gromacs 2016.3

2017-06-15 Thread Mark Abraham
Hi, Redmine.gromacs.org is the place. Please add enough inputs to reproduce the problem! Mark On Thu, 15 Jun 2017 20:42 Charles Laughton < charles.laugh...@nottingham.ac.uk> wrote: > Hi Carsten, > > Can you explain how I file a bug report? Do I need to be subscribed to the > gmx-developers list

Re: [gmx-users] Problems with IMD in Gromacs 2016.3

2017-06-15 Thread Charles Laughton
Hi Carsten, Can you explain how I file a bug report? Do I need to be subscribed to the gmx-developers list or something? Regards, Charlie On 15/06/2017, 13:50, "gromacs.org_gmx-users-boun...@maillist.sys.kth.se on behalf of Kutzner, Carsten" wrote: Hi Charlie, I just made a qui

Re: [gmx-users] Problems with IMD in Gromacs 2016.3

2017-06-15 Thread Kutzner, Carsten
Hi Charlie, I just made a quick check with 5.1 and 2016 and I also see the problem that you described. For me IMD works with 5.1, but not with 2016, but I don't know why. Could you file a bug report? Thank you, Carsten > On 14. Jun 2017, at 18:05, Charles Laughton > wrote: > > Hi, > > I h

[gmx-users] Problems with IMD in Gromacs 2016.3

2017-06-14 Thread Charles Laughton
Hi, I have been using the IMD facility in Gromacs 5.1.4 for some time without problems, but I have now updated to Gromacs 2016.3 and there are errors (I can’t connect to mdrun from e.g. VMD). Possibly it has something to do with endian-ness issues? Here are snippets of a job run with 5.1.4: %