[email protected] wrote:
Hi,
I have installed Gromacs without error, however, the testset result in:
FAILED. Check files in rb1
1 out of 16 simple tests FAILED
FAILED. Check files in dec+water
1 out of 14 complex tests FAILED
I do not worry about the dec+water, since it is explained in the
testset, but I don't know what to do about rb1. No output is found.
What should I do??
The test set is currently getting an overhaul. The simple/rb1 test is
flawed, as I mentioned on gmx-developers yesterday. IIRC, I found
versions 3.3.3 and 3.3.2 would fail simple/rb1, but 4.0.5 would pass it
even with the flaw.
It is always a good idea to cite the version number you are using
whenever discussing GROMACS, since there are known bugs and issues.
Mark
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