On Tue, Feb 24, 2009 at 10:54 PM, Raj Jose <isodna05@xxxxxxxxx> wrote:
Hello Dr. Edward,
1. I did get the newer code
svn co svn://svn.gna.org/svn/relax/1.3 relax-1.3
i did try the commands you provided value.display('S2') etc, and it does
work fine now. Secondly i also replaced the modelfree4 binary with the
Portland compiler version.
That's good to hear. If you encounter any other problems, please feel
free to report these. There is also a convenient bug tracking system
for relax located at https://gna.org/bugs/?group=relax. Old bugs can
be seen here if the "display criteria" are changed. As for the
modelfree4 binary, this is not an issue at all. The test suite
failure was just because the test was too stringent for both
modelfree4 binaries, but I'll fix this. Both relax's and modelfree4's
operation is perfectly fine.
2. when i ran the test suites usinf the new relax binary ( in the new
relax1.3 directory), i get a failure ( FAIL: Test the use of randomised
RDCs to find the alignment tensor) and multiple errors. can you take a look
at the output file in the attachments.
This is code I'm currently implementing. All 3 failures/errors are
because of unimplemented code. Unless you are using RDCs for a
Lipari-Szabo model-free analysis, this shouldn't be a problem ;)
3. Also when I issue the relax command , i get the following error.
relax
ImportError: relaxation curve fitting is unavailable, the corresponding C
modules have not been compiled.
This is because the C modules have not been compiled. This is only
for the fitting of the R1 and R2 relaxation rates to the exponential
curves. If you need this, instructions are given at
https://mail.gna.org/public/relax-users/2008-08/msg00003.html.
Regards,
Edward
Re: question regarding output format