Re: dimer

Hi Edward, an additional question: in the output file I noticed that the last four residues at the C-terminus, for which I provided relaxation data, are not included. Any reason for it? (for the previous 9 residues we did not have the assignment because they are not observed due to intermediate

Re: dimer

June 2014 23:32, Stefano Luciano Ciurli stefano.ciu...@unibo.it wrote: Hi Edward, I reached the end of the calculation of our protein dimer, and everything went smooth. We used two fields, and tomorrow I am about to start collecting the third field data. I wonder how to make it so

dimer

Hi Edward, I reached the end of the calculation of our protein dimer, and everything went smooth. We used two fields, and tomorrow I am about to start collecting the third field data. I wonder how to make it so that the molmol or pymol macros used to visualize the various parameters along the

Re: error message

Thompson's multi-processor framework with OpenMPI (http://www.nmr-relax.com/manual/multi_processor_framework.html). Calculation times can range from less than 1 hour to 2 weeks or more. Regards, Edward On 27 May 2014 17:10, Stefano Luciano Ciurli stefano.ciu...@unibo.it wrote

error message

As for this, I think I solved the problem myself: I only needed to work through the dipolar relaxation, interatomic distance and CSA buttons. Stefano ___ relax (http://www.nmr-relax.com) This is the relax-users mailing list relax-users@gna.org To

Re: numeric values of d and c

Hi Edward, thank you for the exhaustive answer. I have saved the script as a filename.py file in the /relax/Contents/Resources/user_functions directory and tried to run in from within relax using the menu user functions (n-z) - script However, it does not appear to do anything. Any hint? Stefano

Re: numeric values of d and c

Hi Edward, The two numbers should be printed at the bottom. If you see errors, then there is likely to be word wrapping problems - one line has been split into two in the email text. it worked! Thanks!!! Stefano ___ relax

Re: numeric values of d and c

controller' button in the toolbar. - Type Ctrl-Z. The two numbers should be printed at the bottom. If you see errors, then there is likely to be word wrapping problems - one line has been split into two in the email text. Regards, Edward On 18 March 2014 17:06, Stefano Luciano

Re: Error message upon PDB loading

Hello, But for being able to help you, please dont hesitate to make a bug report. https://gna.org/bugs/?func=additemgroup=relax done. Thanks! Stefano ___ relax (http://www.nmr-relax.com) This is the relax-users mailing list relax-users@gna.org To

Re: tests

Hi Troels, You have the mac app relax 3.5 installed ? I have the 3.1.5 Then relax is only reached in the GUI i think. :-) I can make an alias in my .cshrc that points to the GUI, but it does not make sense to use it in place of double clicking the relax butterfly icon To run the

Re: tests

Hi Edward, For the Mac OS X DMG distribution file, you cannot run this from the command line. It is a real Mac app as defined by Mac Frameworks. OK! I apologize for some misunderstandings Therefore you should not add it to your .cshrc file. The only way a Mac OS X app should be opened on

error message

Hello, I keep having the following error. I looked into the mailing list and I think I cleaned up the spin container in order to keep only the spins that are contained in the text files originated from Bruker Dynamics Center. ANy hint for help? Thanks, Stefano Traceback (most recent call last):

tests

hello, does anyone know why these tests are failed? Stefano -- Ran 68 tests in 295.869s OK === = Summary of the relax test suite = === Optional

Re: error message

. For example the string '@H*' will select the protons 'H', 'H2', 'H98'. Best Troels 2014-03-14 16:48 GMT+01:00 Stefano Luciano Ciurli stefano.ciu...@unibo.it: Hello, I keep having the following error. I looked into the mailing list and I think I cleaned up the spin container in order to keep