On Tue, 29 Sep 2020 at 17:15, rana <[email protected]> wrote:
> Hi Edward,
>
> Thanks so much for your response. Attached is the response from the relax -i 
> command.
>
> Let me know how to fix this issue,
>
>
> --------------------------------------------------------------------------------------------------------------------------------------
>
>                                             relax 4.1.3
>
>                               Molecular dynamics by NMR data analysis
>
>                              Copyright (C) 2001-2006 Edward d'Auvergne
>                          Copyright (C) 2006-2019 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), Version 3 or any later version published by 
> the Free Software
> Foundation.  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.
>
>
> Hardware information:
>     Machine:                 x86_64
>     Processor:               x86_64
>     Processor name:          Intel(R) Xeon(R) CPU E5-1603 0 @ 2.80GHz
>     Endianness:              little
>     Total RAM size:          64311 Mb
>     Total swap size:         32255 Mb
>
> Operating system information:
>     System:                  Linux
>     Release:                 2.6.32-431.29.2.el6.x86_64
>     Version:                 #1 SMP Sun Jul 27 15:55:46 EDT 2014
>     GNU/Linux version:       Red Hat Enterprise Linux Workstation 6.5 Santiago
>     Distribution:            redhat 6.5 Santiago
>     Full platform string:    
> Linux-2.6.32-431.29.2.el6.x86_64-x86_64-with-redhat-6.5-Santiago
>
> Python information:
>     Architecture:            64bit ELF
>     Python version:          2.7.17
>     Python branch:
>     Python build:            default, Dec 27 2019 10:50:24
>     Python compiler:         GCC 4.4.7 20120313 (Red Hat 4.4.7-16)
>     Libc version:            glibc 2.2.5
>     Python implementation:   CPython
>     Python revision:
>     Python executable:       /opt/python2.7/bin/python
>     Python flags:            sys.flags(debug=0, py3k_warning=0, 
> division_warning=0, division_new=0, inspect=0, interactive=0, optimize=0, 
> dont_write_bytecode=0, no_user_site=0, no_site=0, ignore_environment=0, 
> tabcheck=0, verbose=0, unicode=0, bytes_warning=0, hash_randomization=0)
>     Python float info:       sys.float_info(max=1.7976931348623157e+308, 
> max_exp=1024, max_10_exp=308, min=2.2250738585072014e-308, min_exp=-1021, 
> min_10_exp=-307, dig=15, mant_dig=53, epsilon=2.220446049250313e-16, radix=2, 
> rounds=1)
>     Python module path:      ['/opt/relax-4.1.3', 
> '/opt/python2.7/lib/python27.zip', '/opt/python2.7/lib/python2.7', 
> '/opt/python2.7/lib/python2.7/plat-linux2', 
> '/opt/python2.7/lib/python2.7/lib-tk', 
> '/opt/python2.7/lib/python2.7/lib-old', 
> '/opt/python2.7/lib/python2.7/lib-dynload', 
> '/opt/python2.7/lib/python2.7/site-packages']
>
> Python packages and modules (most are optional):
>
> Name               Installed    Version             Path
> minfx              True         1.0.11              
> /opt/python2.7/lib/python2.7/site-packages/minfx
> bmrblib            True         1.0.4               
> /opt/python2.7/lib/python2.7/site-packages/bmrblib
> numpy              True         1.16.5              
> /opt/python2.7/lib/python2.7/site-packages/numpy
> scipy              True         1.2.2               
> /opt/python2.7/lib/python2.7/site-packages/scipy
> wxPython           False
> matplotlib         False
> mpi4py             False
> epydoc             False
> optparse           True         1.5.3               
> /opt/python2.7/lib/python2.7/optparse.pyc
> readline           True                             
> /opt/python2.7/lib/python2.7/lib-dynload/readline.so
> profile            True                             
> /opt/python2.7/lib/python2.7/profile.pyc
> bz2                True                             
> /opt/python2.7/lib/python2.7/lib-dynload/bz2.so
> gzip               True                             
> /opt/python2.7/lib/python2.7/gzip.pyc
> io                 True                             
> /opt/python2.7/lib/python2.7/io.pyc
> xml                True         0.8.4 (internal)    
> /opt/python2.7/lib/python2.7/xml/__init__.pyc
> xml.dom.minidom    True                             
> /opt/python2.7/lib/python2.7/xml/dom/minidom.pyc
>
> relax information:
>     Version:                 4.1.3
>     Processor fabric:        Uni-processor.
>
> relax C modules:
>
> Module                        Compiled    File type    Path
> target_functions.relax_fit    True                     
> /opt/relax-4.1.3/target_functions/relax_fit.so

This is what I thought.  Your relax installation is not using the
minfx and bmrblib versions that come with it.  Can you also paste the
output of:

$ ls -alh /opt/relax-4.1.3

This should show a minfx/ and bmrblib/ directory, but my guess is that
those are not present.  The minfx version being used is a Python
installed site-package.  However the version being used is too old and
no longer functional with modern numpy.  Minfx is up to version 1.0.12
[1], and it is that version that must now be used.  Did you install
this yourself?  Do you know how it was installed?

Regards,

Edward


[1]  https://sourceforge.net/p/minfx/code/ref/master/tags/


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