ASCII summary

From: Tanya L. Young <tyoung_at_ksu.edu>
Date: Thu, 16 Jan 2003 08:48:55 -0600

Again, thanks for all the input! Here is a summary of the options for
putting VNMR spectra into presentations. This is by no means comprehensive!


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Options for exporting spectra to ASCII in VNMR:
-maclib/writetrace; see
http://www.varianinc.com/nmr/apps/usergroup/toc/ul_image/maclib/writetrace.h
tml
- bin/parhandler (also user library, writes a large variety
of JCAMP-DX formats, including X,Y data); see
http://www.varianinc.com/nmr/apps/usergroup/toc/ul_image/bin/parhandler.html
-maclib/writespec
"writespec - write a (portion of a) spectrum into an ASCII file"
"                                       S.L.Patt, 30 March 1993"
"usage: writespec('filename') writes the spectrum from sp+wp to sp"
"         into a file in an ASCII format"
if ($#<1) then
  write('error','Usage: writespec(\'filename\')')
else
  mark('reset')
  write('line3','Creating file %s...',$1)
  write('reset',$1)
  $delta=sw/(fn/2-1) $f=sp+wp
  repeat
    mark($f):$ht
    $ppm=$f/sfrq
    write('file',$1,'%f   %f',$ppm,$ht)
    $f=$f-$delta
  until $f<sp
  write('error','Done!')
endif
Software Packages which NMR data can be processed and then exported to ASCII
Nuts, Mest-ReC, XWINNMR, ACD Labs Spectrum Manager/HNMR/CNMR, Delta, Dyana,
FELIX-2000/95, Mest-R-Ce, NMR-pipe, NMR-View, etc.
SpinWorks (Kirk Marat, University of Manitoba): :
ftp://davinci.chem.umanitoba.ca/pub/marat/SpinWorks
Options for making 'image' exports.
Write to HPGL or Postscript files.  These files are then imported into
presentations as .hgl or .ps files or can be converted into .jpg, .gif, etc.
You could also use jdesign from VNMR command prompt, set your design
template, import the spectrum from VNMR window into there and then write
that out into any one of about 30 image formats like jpg, gif, tif,
whatever.
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Tanya L. Young, Ph.D.
Senior Scientist and NMR Spectroscopist
Department of Chemistry
Kansas State University
111 Willard Hall
Manhattan, KS 66506
785-532-6477
tyoung_at_ksu.edu

Received on Thu Jan 16 2003 - 09:49:58 MST