[gmx-developers] pbc_dx function

[Dallas B. Warren]

> The *only* exception here is the .tpr, which is intended as 'one-time'

> intermediate  between the pre-processing (grompp) and MD engine
(mdrun). 
> Nevertheless, since a great many versions, tpr files are at least
downward 
> compatible (i.e., newer gromacs versions also read old(er) tpr files).

And that is my issue.  The newer tpr files are not recognised by the
script that was compiled with an older version of GROMACS.

Catch ya,

Dr. Dallas Warren
Lecturer
Department of Pharmaceutical Biology and Pharmacology
Victorian College of Pharmacy, Monash University
381 Royal Parade, Parkville VIC 3010
dallas.warren at vcp.monash.edu.au
+61 3 9903 9524
---------------------------------
When the only tool you own is a hammer, every problem begins to resemble
a nail.