[gmx-users] installation

Justin Lemkul jalemkul at vt.edu
Wed Feb 13 03:27:24 CET 2013



On 2/12/13 9:24 PM, David Sáez wrote:
> Hello everybody, I'm trying to install Gromacs 4.6 in my Ubuntu 12.04
> laptop. As I am not a a skilled user, I tried the Quick and Dirty
> Installation, After following the instructions I obtained this message when
> trying to execute GMXRC:
>
> david at HAL-9000:~$ /usr/local/gromacs/bin/GMXRC
> /usr/local/gromacs/bin/GMXRC: line 34: return: can only `return' from a
> function or sourced script
> /usr/local/gromacs/bin/GMXRC: line 43: CSH:: command not found
> /usr/local/gromacs/bin/GMXRC.csh: line 8: syntax error near unexpected
> token `setenv'
> /usr/local/gromacs/bin/GMXRC.csh: line 8: `if (! $?LD_LIBRARY_PATH) setenv
> LD_LIBRARY_PATH ""'
>
> Could someone give some help?
>

Note the first error - you need to source the file.

$ source /usr/local/gromacs/bin/GMXRC

-Justin

-- 
========================================

Justin A. Lemkul, Ph.D.
Research Scientist
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

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