[gmx-users] Re: gmx-users digest, Vol 1 #212 - 15 msgs
Lynne Bilston
l.bilston at unsw.edu.au
Wed Apr 17 12:03:35 CEST 2002
Sergio,
No fix, but g_energy from v 3.0 works fine with .edr files from the newer
versions of mdrun. Let me know if you need the old binary, or just
recompile it yourself.
Erik,
I sent a small energy file to David, and debug output as I recall, but I
don't think he could replicate it. Certainly Bert de Groot said he wasn't
having problems with g_energy on his alpha machines.
I'm happy to dig the stuff out for you if it's helpful, although I'm a bit
busy configuring my new dual athlon machines at the moment..
-Lynne
>Hi,
>
>I'm encountering a problem regarding g_energy in the same way as reported by
>Lynne E. Bilston one month ago (floating exception messages after invoking
>the g_energy program. I'm also running gromacs (v. 3.1.3) on a Digital Alpha
>machine under Tru64 Unix v.5.0. The same happens with gmxdump -e energy.edr
>| more. Does anyone know how to fix it?
>
>Thank you,
>
>Sergio
>
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