[gmx-users] Problems with gromacs-openMM

jorge_quintero at ciencias.uis.edu.co jorge_quintero at ciencias.uis.edu.co
Fri Jan 29 16:05:21 CET 2010


Thanks a lot!!! it works


> Hi,
>
>
> try to do add the OpenMM library dir to your library path before running
> make
>
> $ export LD_LIBRARY_PATH=/opt/openmm/lib:$LD_LIBRARY_PATH
>
>
> Also, OpenMM support will be officially available in the next Gromacs
> release (soon).
>
> Rossen
>
> On 1/27/10 4:28 AM, jorge_quint... at ciencias.uis.edu.co wrote:
>
>     make[3]: *** No hay ninguna regla para construir el objetivo
>     `/usr/local/openmm/lib/libOpenMM.*', necesario para `grompp'.  Alto.
>     make[3]: se sale del directorio `/root/gromacs-4.0.7/src/kernel'
>     make[2]: *** [all-recursive] Error 1
>     make[2]: se sale del directorio `/root/gromacs-4.0.7/src'
>     make[1]: *** [all] Error 2
>     make[1]: se sale del directorio `/root/gromacs-4.0.7/src'
>     make: *** [all-recursive] Error 1
>
> --
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