[gmx-users] gmxtest seems to have missing files

David van der Spoel spoel at xray.bmc.uu.se
Thu Nov 29 19:03:59 CET 2007

Amin Astaneh wrote:
> Hello gmx-users list:
> I downloaded the gmxtest tarball to test my installation. When I ran it, 
> I get these errors:
probably meant that you haven't run source GMXRC
test it using the command:

> 69:0 gmxtest # ./gmxtest.pl simple
> No topol.tpr file in angles1. grompp failed
> FAILED. Check files in angles1
> No topol.tpr file in angles125. grompp failed
> FAILED. Check files in angles125
> No topol.tpr file in bham. grompp failed
> FAILED. Check files in bham
> ...
> It seems that the test suite requires a topol.tpr file in each test case 
> directory. There are none.
> Thank you for your time.
> Amin Astaneh
> USF Research Computing
> http://rc.usf.edu
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David van der Spoel, Ph.D.
Molec. Biophys. group, Dept. of Cell & Molec. Biol., Uppsala University.
Box 596, 75124 Uppsala, Sweden. Phone:	+46184714205. Fax: +4618511755.
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://folding.bmc.uu.se

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