[gmx-users] Is there a test set for GROMACS 3.3.1 ?
mariagoranovic at gmail.com
Tue Oct 2 17:20:08 CEST 2007
The wiki refers to a test set for the upcoming 3.3.2 version. Is there a
test set for the 3.3.1 version as well ?
I tried running the test set for 3.3.2 after installing 3.3.1 and ran into a
host of errors, but that is probably because of the different version ?
Here are some of the errors anyway:
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
No topol.tpr file in bonds1. grompp failed
FAILED. Check files in bonds1
Thank you for the help,
Technical University of Denmark
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