[gmx-users] problem with g_energy in 3.3.1
Paul van Maaren
maaren at home.nl
Sat May 13 22:51:32 CEST 2006
+++ James Rustad [Sat, May 13, 2006 at 12:56:50PM -0700]:
> I find that when I try to run the new g_energy, I don't get numbers by
> the categories (pressure, temperature, x-box, etc.) and can't select
> them. If I move the ener.edr file over to my other machine with 3.3,
> the thing reads fine. Anyone else have this problem in 3.3.1?
The functionality has indeed changed, due to a feature request (check the
list archives for details).
You can now select the categories by name, e.g:
g_energy << EOF
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