gissmo2spinach.m

From Spinach Documentation Wiki
Jump to: navigation, search

Reads GISSMO files and forms Spinach data structures.

Syntax

    [sys,inter]=gissmo2spinach(file_name,subsystem)

Arguments

   file_name  -  character string with the name of 
                 the GISSMO XML file

   subsystem  -  which of the coupling matrices to 
                 to import

Outputs

   sys, inter -  Spinach data structures, ready for
                 calling create.m

Notes

GISSMO only provides chemical shifts, J-couplings, the non-selective line width, and the magnet field. You may want to add further parameters by editing sys and inter data structures manually.

See also

x2spinach.m, gparse.m, oparse.m, g2spinach.m, s2spinach.m, protein.m, nuclacid.m


Version 2.3, authors: Ilya Kuprov