[gmx-users] Testing

David Chan dichan at ucalgary.ca
Fri Aug 1 16:46:33 CEST 2008

I did actually run the test set on an earlier installation of gromacs on 
this computer and I just ran it again to see what the output would be. 
The only error I receive is in the dec+water files, which is described 
in the wiki as 'unimportant' (I did check the #s and they are similar to 
what was described). So I missed the gcc error even though I was using 
the test set.

Now that I think about it I do recall seeing something about the gcc 
version previously, but I didn't put it all together. I just saw the 
warning at: http://www.gromacs.org/content/view/79/58/  I don't recall 
seeing it there before. My apologies if I simply missed it when 
downloading the files earlier. Since I had downloaded these files 
previously I was reading the installation procedure in the documentation 
(http://www.gromacs.org/content/view/19/32/) - maybe a line in there 
would be good, too?

Thanks Chris & David for your help! I am reinstalling now - hopefully 
everything will work after that!


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