David Chan wrote:
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!

Although this kind of errors can be triggered by the compiler, they can sometimes be remedied with a work around. So please consider submitting a bugzilla anyway. It is in everyones interest to prevent this kind of problems.


David


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David.
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David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
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