Thanks Charles for the quick response. I found the script, but couldn’t find the input NEF file (test1.nef). Is this the same file you provided to NEF GitHub? Can I take it from there? Or is it hidden in some other folder? Thanks, Kumaran
> On Jul 31, 2019, at 3:56 PM, Charles Schwieters <[email protected]> > wrote: > > Hello Kumaran-- > >> >> May I know how for how far XPLOR-NIH (V 2.51) >> can support NMR Exchange Format(NEF)? Can I specify all >> restraints(RDC, NOE and angle) in NEF file(instead of several tbl >> files) in your folding(fold.py) and refinement(refine.py) protocol? If >> you have some example with NEF input files, that would be very useful. > > In eginput/gb1_rdc/testNEF.py distributed with Xplor-NIH 2.51, the > bottom portion of the script is a demonstration of how to read in > these sort of restraints. Please let me know if you run into trouble > with this. > > thanks-- > Charles > > ######################################################################## > > To unsubscribe from the XPLOR-NIH list, click the following link: > http://list.nih.gov/cgi-bin/wa.exe?SUBED1=XPLOR-NIH&A=1 ######################################################################## To unsubscribe from the XPLOR-NIH list, click the following link: http://list.nih.gov/cgi-bin/wa.exe?SUBED1=XPLOR-NIH&A=1
