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:
luck


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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--
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