[gmx-users] gmx mdrun, VERSION 5.0.2

[Mark Abraham]

Hi,

You've been using 5.1.4, not just 5.0.2. Older software can't know details
about what newer software does, and the .tpr file format is one of those
details. Make your tpr with 5.0.2

Mark

On Fri, Feb 2, 2018 at 4:23 PM K. Subashini <subashinik at hotmail.com> wrote:

> Hi gmx users,
>
> I use GROMACS version 5.0.2
>
> I got the following error, while giving gmx mdrun -nt 8 -v -deffnm NVT.tpr
>
> Reading file NVT.tpr, VERSION 5.1.4 (single precision)
> -------------------------------------------------------
> Program mdrun, VERSION 5.0.2
> Source code file: /opt/gromacs-5.0.2/src/gromacs/fileio/tpxio.c, line: 3303
> Fatal error:
> reading tpx file (NVT.tpr) version 103 with version 100 program
>
> I follow the gromacs tutorial (By Dr.Justin) which is for version 5.x
> series. Why do I face this error?
>
> Anything wrong with my input file?
>
> Thanks,
> Subashini.K
>
>
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