[gmx-users] Tee-rex compilation error

[Marcus Kubitzki]

Hi Ramon,

the TEE-REX patch only works with GMX 3.3.1. I tried to compile
it in 3.3.3 but it didn't work due to some subtle changes done
going from 3.3.1 to 3.3.3.

With 3.3.1 TEE-REX should work fine.

Marcus

Ramon Crehuet wrote:
> Dear gromacs users,
> I have installed and compiled gromacs-3.3.3 without problems. Now I have
> installed the tee-rex patch. When I compile I get the following error:
> 
>  cc -DHAVE_CONFIG_H -I. -I. -I../../src -I../../include
> -DGMXLIBDIR=\"/usr/local/gromacs/share/top\" -O3 -fomit-frame-pointer
> -finline-functions -Wall -Wno-unused -funroll-all-loops -MT sim_util.lo
> -MD -MP -MF .deps/sim_util.Tpo -c sim_util.c -o sim_util.o
> sim_util.c: In function 'init_md':
> sim_util.c:849: warning: passing argument 5 of 'init_vcm' makes pointer
> from integer without a cast
> sim_util.c:849: error: too many arguments to function 'init_vcm'
> make[3]: *** [sim_util.lo] Error 1
> make[3]: Leaving directory `/root/gromacs-3.3.3/src/mdlib'
> make[2]: *** [all-recursive] Error 1
> make[2]: Leaving directory `/root/gromacs-3.3.3/src'
> make[1]: *** [all] Error 2
> make[1]: Leaving directory `/root/gromacs-3.3.3/src'
> make: *** [all-recursive] Error 1
> 
> When I compile with --enable-mpi using lam 7.1.2 I get the same error.
> My compiler is gcc-4.1.2 in an opensuse 10.3
> Any ideas on how to solve this?
> Thanks in advance,
> Ramon
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-- 
Dr. Marcus Kubitzki
Max Planck Institute for Biophysical Chemistry
Computational Biomolecular Dynamics Group
Am Fassberg 11
D-37077 Göttingen
Germany
phone: ++49-551-2012312
fax: ++49-551-2012302
Email: mkubitz[at]gwdg.de
www: http://www.mpibpc.mpg.de/groups/de_groot/