[gmx-users] reading tpx file (md_0_1.tpr) version 100 with version 83 program:regenerated tpr problem persist

[Justin Lemkul]

On 1/23/16 11:49 AM, Nikhil Maroli wrote:
> Dear all,
> i wanted to do g_mmpbsa on a trajectory obtained from Gromacs 5.1.1 ,which
> is not supported by g_mmpbsa .so using Gromacs 5.0 i made the *.tpr file
> and try to invoke the command
>
>
>     -
>
>     g_mmpbsa -f md_0_1.xtc -s md_0_1.tpr -n index.ndx -pdie 2 -decomp
>     - but end up with fatal error
>     - reading tpx file (md_0_1.tpr) version 100 with version 83 program
>
> i seen in mailing list making .tpr is sufficient to overcome this issue
> ,but still why am i getting this error?!
>

Because your old version isn't old enough.  IIRC .tpr version 83 was somewhere 
in the 4.5.x or 4.6.x series.

-Justin

-- 
==================================================

Justin A. Lemkul, Ph.D.
Ruth L. Kirschstein NRSA Postdoctoral Fellow

Department of Pharmaceutical Sciences
School of Pharmacy
Health Sciences Facility II, Room 629
University of Maryland, Baltimore
20 Penn St.
Baltimore, MD 21201

jalemkul at outerbanks.umaryland.edu | (410) 706-7441
http://mackerell.umaryland.edu/~jalemkul

==================================================