Hi Andras, If you update relax and recompile the C modules:
$ svn up $ scons clean_all $ scons Then run your system test: $ relax -sd Relax_fit.test_saturation_recovery You should now see that the test passes. I have implemented the saturation recovery equations, gradients, and Hessians in the new target_functions/exponential_sat.c file. If you would like to create Sparky files for the inversion recovery experiment, where I0 < Iinf, I could do the same thing for this curve type as well. Cheers, Edward On 29 November 2014 at 16:58, Edward d'Auvergne <edw...@nmr-relax.com> wrote: > Hi Andras, > > I've now added this: > > - The script has been added > (http://article.gmane.org/gmane.science.nmr.relax.scm/24570). > - Modified the script to work as a system test > (http://article.gmane.org/gmane.science.nmr.relax.scm/24572). > - Updated the copyright notice with your name > (http://article.gmane.org/gmane.science.nmr.relax.scm/24574). > - Created the system test > (http://article.gmane.org/gmane.science.nmr.relax.scm/24575). > > Your script can now be run by typing: > > $ relax -sd Relax_fit.test_saturation_recovery > > Regards, > > Edward > > > > On 29 November 2014 at 15:23, Boeszoermenyi, Andras > <andras_boeszoerme...@hms.harvard.edu> wrote: >> Dear Edward, >> >> thanks a lot for the great explanations. >> >> Unfortunately, I cannot figure out, what to paste where and rename to what. >> >> I won't feel offended though, if you implement it. >> >> Best, >> Andras >> ________________________________________ >> From: edward.dauver...@gmail.com [edward.dauver...@gmail.com] On Behalf Of >> Edward d'Auvergne [edw...@nmr-relax.com] >> Sent: Friday, November 28, 2014 1:24 PM >> To: Boeszoermenyi, Andras >> Cc: relax-devel@gna.org; Sébastien M >> Subject: Re: [sr #3195] Fitting of saturation recovery experiment >> >> Hi Andras, >> >> To push changes into the source code repository, you'd have to become >> a relax developer. If you are interested, I'd recommend first reading >> of the 'open source infrastructure' and 'relax development' chapters >> of the manual. These chapters outline the procedure in full detail. >> Do you have experience with CVS, subversion, git, or other source code >> revision control systems? >> >> The first step to have changes made to relax is to upload either files >> or patches to a relax task, and ask for it to be included or applied. >> For example I could take the script you have just attached to the task >> in the 'saturation_recovery.tar.gaz' file (https://gna.org/task/?7415, >> https://gna.org/task/download.php?file_id=22997), and place this into >> the relax system test directories. However, if you feel adventurous, >> you could try to create your own system test from this! I could then >> incorporate your self designed test and add this to relax. Creating >> this test is rather straight forward: >> >> >> - Firstly you will need a copy of the relax trunk in your home >> directory that you can modify yourself. The /sw/lib/ version is no >> good for this. >> >> >> - Copy your script to the new file >> test_suite/system_tests/scripts/relax_fit_saturation_recovery.py. Add >> this to the repository by typing: >> >> $ svn add test_suite/system_tests/scripts/relax_fit_saturation_recovery.py >> >> You can then see the status of the relax source code by typing: >> >> $ svn st >> >> which will show your newly added script. >> >> >> - The next step would be to add a copyright notice. Open any relax >> *.py file and copy the notice from the top into your script. Remove >> all authors and place your name and the year there. You could also >> include the link to your Gna! profile in brackets after your name >> (https://gna.org/users/andras). >> >> >> - Then to create the test itself. I would suggest that this is called >> Relax_fit.test_saturation_recovery. Open the >> test_suite/system_tests/relax_fit.py in a text editor (preferably >> something such as gvim or emacs where source code is recognised, and >> coloured, and the programs help you with the code). Copy the 11 lines >> of the test_zooming_grid_search() method >> (http://www.nmr-relax.com/api/3.3/test_suite.system_tests.relax_fit-pysrc.html#Relax_fit.test_zooming_grid_search) >> and paste and rename it to test_saturation_recovery(). Be sure that >> alphabetical order is preserved. Change the script name to your >> script, and the chi-squared value to 0.0, and the I0 and Rx values to >> your values. As you are changing this file, add a new line to the >> copyright notice with your name and the year. >> >> >> - Try running the test with: >> >> $ relax -s Relax_fit.test_saturation_recovery >> >> >> - This will probably not run straight away, as you need to fix the >> paths in the script. Open your script and the >> test_suite/system_tests/scripts/relax_fit_zooming_grid.py script >> side-by-side (run 'svn up' now as I just simplified this reference >> script for you). Note the use of the relax status object (used to >> find where relax is installed) and the os.sep Python module to support >> all operating systems, as '/' in Windows is '\' (fortunately Macs >> don't use ':' as a folder separator any more). After this the test >> should run and be complete. Yet it will fail due to the chi-squared >> and parameter check, and because the saturation-recovery equations are >> not implemented yet. >> >> >> - Finally prepare a patch by typing: >> >> $ svn diff > patch >> >> This will contain all the changes, including the new script file. >> Upload the 'patch' file to the task, remembering to add a comment >> describing the patch. You may even wish to create your own commit >> message - see the development chapter. >> >> >> - Code review. I'll look at the patch and make suggestions for >> improvements. Changes can be made and a new patch created and >> uploaded. >> >> >> - Once the patch is in a good state, I can apply it to the relax >> trunk and permanently commit the change to the repository. >> >> >> This is essentially the starting procedure for becoming a developer. >> Many more details are given in the development chapter. The reason >> I'm mentioning all of this now is because it's 7 pm Friday evening >> here and I won't have a chance to look at this until next week. For >> me, creating this test is less than 5 min of work. If you have the >> interest, feel free to try it out yourself. >> >> Regards, >> >> Edward >> >> >> P. S. As for deleting files, this is not possible. The >> infrastructure that relax uses, and open source infrastructure in >> general, is deliberately designed so that everything is permanent. >> >> >> >> On 28 November 2014 at 18:38, Boeszoermenyi, Andras >> <andras_boeszoerme...@hms.harvard.edu> wrote: >>> Hi, >>> >>> great, this really helped. >>> >>> The script runs now for exponential fitting 'exp' and throws an error for >>> inversion recovery fitting 'inv'. >>> >>> I uploaded a new saturation recovery folder: >>> >>> file #22997: saturation_recovery.tar.gaz >>> >>> Is there a way to remove the old one? And is there a way for me to push >>> changes through svn? >>> >>> Best, >>> Andras >>> ____________________________ >>> From: edward.dauver...@gmail.com [edward.dauver...@gmail.com] On Behalf Of >>> Edward d'Auvergne [edw...@nmr-relax.com] >>> Sent: Friday, November 28, 2014 12:16 PM >>> To: Boeszoermenyi, Andras >>> Cc: relax-devel@gna.org; Sébastien M >>> Subject: Re: [sr #3195] Fitting of saturation recovery experiment >>> >>> Hi, >>> >>> Ok, then you're almost there. You'll need to obtain a copy of minfx >>> (https://gna.org/projects/minfx/) and bmrblib >>> (https://gna.org/projects/bmrblib/). These used to be relax packages, >>> but they have been spun out into their own for others to take >>> advantage of. For this, type: >>> >>> $ cd /sw/lib/relax-trunk/ >>> $ svn co http://svn.gna.org/svn/minfx/tags/1.0.11/minfx >>> $ svn co http://svn.gna.org/svn/bmrblib/tags/1.0.3/bmrblib >>> >>> This is performed when a new relax release is made so that minfx and >>> bmrblib are bundled with relax, but this needs to be performed >>> manually when using the most cutting edge code. Note that it is much >>> better to place the relax-trunk into your home directory as this will >>> be constantly modified by the relax developers. Then, as a normal >>> user (without sudo), you can obtain the latest code by typing: >>> >>> $ svn up >>> >>> Regards, >>> >>> Edward >>> >>> >>> P. S. The command for showing the PATH environmental variable is >>> "echo $PATH" rather than just "$PATH". >>> >>> >>> >>> >>> >>> >>> >>> On 28 November 2014 at 18:07, Boeszoermenyi, Andras >>> <andras_boeszoerme...@hms.harvard.edu> wrote: >>>> Hi, >>>> >>>> so I aliased relax to the trunk relax and can start it now, but here is >>>> the problem: >>>> >>>> File "/sw/lib/relax-trunk/relax", line 4, in <module> >>>> import relax >>>> File "/sw/lib/relax-trunk/relax.py", line 37, in <module> >>>> import dep_check >>>> File "/sw/lib/relax-trunk/dep_check.py", line 90, in <module> >>>> if not minfx.__version__ == 'trunk' and >>>> version_comparison(minfx.__version__, min_version) == -1: >>>> AttributeError: 'module' object has no attribute '__version__' >>>> >>>> which relax now gives: >>>> >>>> which relax >>>> relax: aliased to /sw/lib/relax-trunk/relax >>>> >>>> and $PATH: >>>> >>>> /sw/bin:/sw/sbin:.:/Applications/NMRpipe/nmrbin.mac:/Applications/NMRpipe/com:/usr/bin:/bin:/usr/sbin:/sbin:/usr/local/bin:/Applications/xplor-nih-2.33/bin:/opt/X11/bin: >>>> Command not found. >>>> >>>> >>>> The locations are: >>>> >>>> /sw/lib/relax-py27/relax_gui_mode.py >>>> /sw/lib/relax-py27/relax_gui_mode.pyo >>>> /sw/lib/relax-trunk/relax_gui_mode.py >>>> >>>> I installed relax previously with fink. Unfortunately, fink does't support >>>> yosemite yet, so I can't install newer versions this way, except for the >>>> app. >>>> >>>> Best regards, >>>> Andras >>>> ________________________________________ >>>> From: edward.dauver...@gmail.com [edward.dauver...@gmail.com] On Behalf Of >>>> Edward d'Auvergne [edw...@nmr-relax.com] >>>> Sent: Friday, November 28, 2014 11:46 AM >>>> To: Boeszoermenyi, Andras >>>> Cc: relax-devel@gna.org; Sébastien M >>>> Subject: Re: [sr #3195] Fitting of saturation recovery experiment >>>> >>>> Hi, >>>> >>>> Hmmm, this might be difficult to work out due to the number of >>>> possibilities (Fink, Homebrew, framework installs, standard installs, >>>> etc.). So I'd need a bit more information. Which method did you use >>>> to obtain the code for the relax trunk? Do you have Xcode, Scons, >>>> subversion, Python, etc. installed all via DMG packages? How did you >>>> install relax to start with? Are you the administrator for your >>>> computer? To find the different relax installations, maybe type: >>>> >>>> $ sudo /usr/libexec/locate.updatedb >>>> $ locate relax_gui_mode.py >>>> >>>> Could you copy and paste the output of this into a mail? This should >>>> find all places where relax is located (the relax_gui_mode.py script >>>> is simply a unique file name). Then to find out where the default >>>> relax is, type: >>>> >>>> $ which relax >>>> >>>> This will be the version that runs when you type 'relax'. If you have >>>> the relax trunk in the ~/relax-trunk directory (where ~ is your home >>>> directory), then to run this version type: >>>> >>>> $ ~/relax-trunk/relax >>>> >>>> Does this work for you? You can sometimes override the version >>>> installed in /usr/local/ by creating a 'bin' directory and linking the >>>> main relax file: >>>> >>>> $ cd ~ >>>> $ mkdir bin >>>> $ cd bin >>>> $ ln -s ~/relax-trunk/relax >>>> $ cd >>>> $ which relax >>>> >>>> Replace "~/relax-trunk" with any path you wish. Normally ~/bin will >>>> come before /usr/local in your $PATH environmental variable. To be >>>> sure, could you tell me what you see when you type: >>>> >>>> $ echo $PATH >>>> >>>> Note that in all of the above commands, that the '$ ' is the terminal >>>> or prompt and that you should not type this. >>>> >>>> Regards, >>>> >>>> Edward >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> On 28 November 2014 at 17:30, Boeszoermenyi, Andras >>>> <andras_boeszoerme...@hms.harvard.edu> wrote: >>>>> Hi, >>>>> >>>>> would you happen to know where all these things install themselfes to. I >>>>> am at a complete loss. >>>>> >>>>> Best, >>>>> Andras >>>>> ________________________________________ >>>>> From: edward.dauver...@gmail.com [edward.dauver...@gmail.com] On Behalf >>>>> Of Edward d'Auvergne [edw...@nmr-relax.com] >>>>> Sent: Friday, November 28, 2014 9:53 AM >>>>> To: Boeszoermenyi, Andras >>>>> Cc: relax-devel@gna.org; Sébastien M >>>>> Subject: Re: [sr #3195] Fitting of saturation recovery experiment >>>>> >>>>> Hi, >>>>> >>>>> Somehow the relax-trunk version is not located on the system path or >>>>> it doesn't have priority over the installed 3.1.7 version. You could >>>>> supply the full path to override this, uninstall the 3.1.7 version, or >>>>> change the order of the directories in the $PATH environmental >>>>> variable. >>>>> >>>>> Regards, >>>>> >>>>> Edward >>>>> >>>>> >>>>> >>>>> On 28 November 2014 at 15:47, Boeszoermenyi, Andras >>>>> <andras_boeszoerme...@hms.harvard.edu> wrote: >>>>>> Well I installed the relax-trunk version, but I am not sure if that is >>>>>> what I am running. >>>>>> >>>>>> When I type relax -i >>>>>> >>>>>> I get this header: >>>>>> >>>>>> relax 3.1.7 >>>>>> >>>>>> Molecular dynamics by NMR data analysis >>>>>> >>>>>> Copyright (C) 2001-2006 Edward d'Auvergne >>>>>> Copyright (C) 2006-2014 the relax development >>>>>> team >>>>>> >>>>>> This is free software which you are welcome to modify and redistribute >>>>>> under the conditions of the >>>>>> GNU General Public License (GPL). This program, including all modules, >>>>>> is licensed under the GPL >>>>>> and comes with absolutely no warranty. For details type 'GPL' within >>>>>> the relax prompt. >>>>>> >>>>>> Assistance in using the relax prompt and scripting interface can be >>>>>> accessed by typing 'help' within >>>>>> the prompt. >>>>>> >>>>>> Processor fabric: Uni-processor. >>>>>> >>>>>> Best, >>>>>> Andras >>>>>> >>>>>> ________________________________________ >>>>>> From: edward.dauver...@gmail.com [edward.dauver...@gmail.com] On Behalf >>>>>> Of Edward d'Auvergne [edw...@nmr-relax.com] >>>>>> Sent: Friday, November 28, 2014 9:44 AM >>>>>> To: Boeszoermenyi, Andras >>>>>> Cc: relax-devel@gna.org; Sébastien M >>>>>> Subject: Re: [sr #3195] Fitting of saturation recovery experiment >>>>>> >>>>>> Hi, >>>>>> >>>>>> What do you see when you run: >>>>>> >>>>>> $ relax -i >>>>>> >>>>>> Are you using the latest relax trunk version? Or the 3.3.3 version? >>>>>> I only see this on versions 3.2.3 or earlier, in relax 3.3.0 and later >>>>>> this works. >>>>>> >>>>>> Regards, >>>>>> >>>>>> Edward >>>>>> >>>>>> >>>>>> >>>>>> On 28 November 2014 at 15:40, Boeszoermenyi, Andras >>>>>> <andras_boeszoerme...@hms.harvard.edu> wrote: >>>>>>> That's exactly what I see. >>>>>>> >>>>>>> But you seem to be getting that error too, or am I mixing something up >>>>>>> now? >>>>>>> >>>>>>> Best, >>>>>>> Andras >>>>>>> ________________________________________ >>>>>>> From: edward.dauver...@gmail.com [edward.dauver...@gmail.com] On Behalf >>>>>>> Of Edward d'Auvergne [edw...@nmr-relax.com] >>>>>>> Sent: Friday, November 28, 2014 9:34 AM >>>>>>> To: Boeszoermenyi, Andras >>>>>>> Cc: relax-devel@gna.org; Sébastien M >>>>>>> Subject: Re: [sr #3195] Fitting of saturation recovery experiment >>>>>>> >>>>>>> Hi Andras, >>>>>>> >>>>>>> That message is what happens when you execute the minimise.grid_search >>>>>>> user function on an old relax version. Could you check if you are >>>>>>> running the latest: >>>>>>> >>>>>>> $ relax -i >>>>>>> >>>>>>> This is what I see with the last 3.1 relax release: >>>>>>> >>>>>>> """ >>>>>>> relax 3.1.7 >>>>>>> >>>>>>> Molecular dynamics by NMR data analysis >>>>>>> >>>>>>> Copyright (C) 2001-2006 Edward d'Auvergne >>>>>>> Copyright (C) 2006-2014 the relax development >>>>>>> team >>>>>>> >>>>>>> This is free software which you are welcome to modify and redistribute >>>>>>> under the conditions of the >>>>>>> GNU General Public License (GPL). This program, including all >>>>>>> modules, is licensed under the GPL >>>>>>> and comes with absolutely no warranty. For details type 'GPL' within >>>>>>> the relax prompt. >>>>>>> >>>>>>> Assistance in using the relax prompt and scripting interface can be >>>>>>> accessed by typing 'help' within >>>>>>> the prompt. >>>>>>> >>>>>>> Processor fabric: Uni-processor. >>>>>>> >>>>>>> relax> minimise.grid_search() >>>>>>> Traceback (most recent call last): >>>>>>> File "<console>", line 1, in <module> >>>>>>> AttributeError: 'Uf_object' object has no attribute 'grid_search' >>>>>>> """ >>>>>>> >>>>>>> Regards, >>>>>>> >>>>>>> Edward >>>>>>> >>>>>>> >>>>>>> >>>>>>> >>>>>>> On 28 November 2014 at 15:18, Boeszoermenyi, Andras >>>>>>> <andras_boeszoerme...@hms.harvard.edu> wrote: >>>>>>>> Hi Edward, >>>>>>>> >>>>>>>> I upgraded everything to newest. >>>>>>>> >>>>>>>> I tried to updated the script too, but when I run it I get this error >>>>>>>> message: >>>>>>>> >>>>>>>> File "/sw/lib/relax-py27/multi/processor.py", line 494, in run >>>>>>>> self.callback.init_master(self) >>>>>>>> File "/sw/lib/relax-py27/multi/__init__.py", line 318, in >>>>>>>> default_init_master >>>>>>>> self.master.run() >>>>>>>> File "/sw/lib/relax-py27/relax.py", line 194, in run >>>>>>>> self.interpreter.run(self.script_file) >>>>>>>> File "/sw/lib/relax-py27/prompt/interpreter.py", line 275, in run >>>>>>>> return run_script(intro=self.__intro_string, local=locals(), >>>>>>>> script_file=script_file, show_script=self.__show_script, >>>>>>>> raise_relax_error=self.__raise_relax_error) >>>>>>>> File "/sw/lib/relax-py27/prompt/interpreter.py", line 578, in >>>>>>>> run_script >>>>>>>> return console.interact(intro, local, script_file, >>>>>>>> show_script=show_script, raise_relax_error=raise_relax_error) >>>>>>>> File "/sw/lib/relax-py27/prompt/interpreter.py", line 477, in >>>>>>>> interact_script >>>>>>>> exec_script(script_file, local) >>>>>>>> File "/sw/lib/relax-py27/prompt/interpreter.py", line 352, in >>>>>>>> exec_script >>>>>>>> runpy.run_module(module, globals) >>>>>>>> File "/sw/lib/python2.7/runpy.py", line 180, in run_module >>>>>>>> fname, loader, pkg_name) >>>>>>>> File "/sw/lib/python2.7/runpy.py", line 72, in _run_code >>>>>>>> exec code in run_globals >>>>>>>> File >>>>>>>> "/Users/andrasboeszoermenyi/relax-trunk/test_suite/shared_data/curve_fitting/saturation_recovery/relax_sym.py", >>>>>>>> line 106, in <module> >>>>>>>> minimise.grid_search(inc=11) >>>>>>>> AttributeError: 'Uf_object' object has no attribute 'grid_search' >>>>>>>> >>>>>>>> Not sure if that could be related to my recent upgrade to Yosemite, >>>>>>>> but I think it shouldn't. >>>>>>>> >>>>>>>> I uploaded the project as: >>>>>>>> >>>>>>>> file #22996: saturation_recovery.tar.gz >>>>>>>> >>>>>>>> Best, >>>>>>>> Andras >>>>>>>> >>>>>>>> ________________________________________ >>>>>>>> From: edward.dauver...@gmail.com [edward.dauver...@gmail.com] On >>>>>>>> Behalf Of Edward d'Auvergne [edw...@nmr-relax.com] >>>>>>>> Sent: Thursday, November 27, 2014 1:16 PM >>>>>>>> To: Boeszoermenyi, Andras >>>>>>>> Cc: relax-devel@gna.org; Sébastien M >>>>>>>> Subject: Re: [sr #3195] Fitting of saturation recovery experiment >>>>>>>> >>>>>>>> Hi Andras, >>>>>>>> >>>>>>>> I have now included your files in relax >>>>>>>> (http://article.gmane.org/gmane.science.nmr.relax.scm/24542). If you >>>>>>>> have the trunk source code copy of relax and type: >>>>>>>> >>>>>>>> $ svn up >>>>>>>> >>>>>>>> You will see the files appear in the >>>>>>>> test_suite/shared_data/curve_fitting/saturation_recovery directory. >>>>>>>> If you could update your script for the latest relax version, I could >>>>>>>> add it to the test_suite/system_tests/scripts/ directory. This would >>>>>>>> then be very simple to set up as a system test by duplicating and >>>>>>>> modifying this test: >>>>>>>> >>>>>>>> http://www.nmr-relax.com/api/3.3/test_suite.system_tests.relax_fit-pysrc.html#Relax_fit.test_zooming_grid_search >>>>>>>> >>>>>>>> Cheers, >>>>>>>> >>>>>>>> Edward >>>>>>>> >>>>>>>> >>>>>>>> On 27 November 2014 at 19:06, Edward d'Auvergne <edw...@nmr-relax.com> >>>>>>>> wrote: >>>>>>>>> Hi Andras, >>>>>>>>> >>>>>>>>> >>>>>>>>>> ok I uploaded a tar file with synthetic peaks for one spin system: >>>>>>>>>> >>>>>>>>>> file #22989 >>>>>>>>> >>>>>>>>> Cheers! The permanent link to the file is >>>>>>>>> http://gna.org/task/download.php?file_id=22989, and this is attached >>>>>>>>> to the task #7415 (http://gna.org/task/?7415). >>>>>>>>> >>>>>>>>> >>>>>>>>>> The saturation recovery formula is: >>>>>>>>>> >>>>>>>>>> I0*(1 - exp(?R1*t)) >>>>>>>>>> >>>>>>>>>> The parameters I used were >>>>>>>>>> >>>>>>>>>> I0 = 1000000000000000.00 >>>>>>>>>> >>>>>>>>>> and >>>>>>>>>> >>>>>>>>>> R1 = 0.5 >>>>>>>>> >>>>>>>>> I'm wondering if this equation is correct. Should this not be: >>>>>>>>> >>>>>>>>> I(t) = I_inf*(1 - exp(?R1*t)) >>>>>>>>> >>>>>>>>> Is the magnitisation not returning to the steady-state of I_inf? I >>>>>>>>> guess that in this experiment I0 == I_inf. >>>>>>>>> >>>>>>>>> >>>>>>>>>> Obviously, the same numbers also work for the inversion recovery >>>>>>>>>> experiment: >>>>>>>>>> >>>>>>>>>> I(t) = I? ? I0*exp(?R1*t) >>>>>>>>>> >>>>>>>>>> with I? set to 1000000000000000.00 as well. Not sure how much that >>>>>>>>>> helps though. >>>>>>>>> >>>>>>>>> If I0 is set to something less than I_inf, this would give different >>>>>>>>> I(t) values. Such a data set could be used to implement the inversion >>>>>>>>> recovery experiment. >>>>>>>>> >>>>>>>>> >>>>>>>>>> If "inv" is not implemented, then that would explain the weird >>>>>>>>>> results :) >>>>>>>>> >>>>>>>>> More of a warning is probably required. Or a synthetic data set, >>>>>>>>> relax script, and system test created, and then this equation finally >>>>>>>>> implemented. >>>>>>>>> >>>>>>>>> >>>>>>>>>> Unfortunately, I have no primary reference for the saturation >>>>>>>>>> recovery experiment either. >>>>>>>>> >>>>>>>>> It's a pity. The ancient primary references for all these basic and >>>>>>>>> old experiment types would be great for adding to the relax manual and >>>>>>>>> user function documentation. I can see that lots of people discuss >>>>>>>>> this older method, but I also don't see any references. >>>>>>>>> >>>>>>>>> I was wondering if you were able to update to the latest version of >>>>>>>>> relax (3.3.3 at http://www.nmr-relax.com/download.html#Mac_OS_X), or >>>>>>>>> even better to use the relax trunk source code >>>>>>>>> (http://thread.gmane.org/gmane.science.nmr.relax.devel/3693/focus=7348). >>>>>>>>> Could you try to update the scripts to run with these versions? The >>>>>>>>> newest relax versions will tell you how the user functions have been >>>>>>>>> renamed. >>>>>>>>> >>>>>>>>> Cheers, >>>>>>>>> >>>>>>>>> Edward _______________________________________________ relax (http://www.nmr-relax.com) This is the relax-devel mailing list relax-devel@gna.org To unsubscribe from this list, get a password reminder, or change your subscription options, visit the list information page at https://mail.gna.org/listinfo/relax-devel
