[gmx-users] problem in gromacs installation

Manik Mayur manik.mayur at gmail.com
Thu Feb 19 18:09:03 CET 2009


On Thu, Feb 19, 2009 at 10:45 AM, nitu sharma <sharmanitu35 at gmail.com>wrote:

> *Dear All,
>
> I have compiled fft-3.2.1 in a specific user directory; then configured,
> compiled gromacs-4.0.3 from source code according to directions and installed it in the
> specific directory, all without any errors, but at the end "make tests"
>
> command fails, the output is:
>
> (if test -d "gmxtest"; then cd "gmxtest"; ./gmxtest.pl all; cd ..; \
> else echo "No gmxtest directory found. Please download and unpack it
> here.";\
>
> fi)
> No gmxtest directory found. Please download and unpack it here.
> *
>
> Unless you specifically want installing test packages, you can test the success of your gromacs installation
by typing "luck" at the console and checking whether it returns
something like "gcq# ...".

*In addition, after "make install" the note was:
>
> "Make sure to update your PATH and MANPATH to find the
> programs and unix manual pages, and possibly LD_LIBRARY_PATH
>
> or /etc/ld.so.conf if you are using dynamic libraries."
>
> Could you please let me know what should I do to resolve the problem regarding make tests
>  and what should I do about the note on PATH and MANPATH?*
>
> If "luck" is working  then you should not worry about setting PATH for your
gromacs programs.

> *Thank you very much in advance
>
> Nitu Sharma
>
> Structural Biology lab
> School Of Life Sciences
> Jawaherlal Nehru University
> *
>
>
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-Manik
-- 
Graduate student
Microfluidics Lab
Dept. of Mechanical Engg.
IIT Kharagpur
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