Chemical exchange software

Alex Bain (bain@mcmail.CIS.McMaster.CA)
Mon, 2 Jun 1997 10:02:59 -0400 (EDT)

Dear People,
I've been writing programs to calculate the lineshapes of systems in
chemical exchange, both coupled and uncoupled. The manual is on the web at

http://www.chemistry.mcmaster.ca/~bain/mexmanc.html

Because we have Brukers here, I have done most of the development with
that software, but I am close to having a Varian version as well.
Courtesy of Vera Mainz, and Patricia Aroca-Ouellette at Toronto, I have a
beta version for VNMR. Any comments or suggestions from VNMR experts who
want to try it out (carefully!) would be most welcome. The Varian version
is
mexico.varian.c

in pub/nmr/mex at bloch.cchem.berkeley.edu. There is a README file with
some of the details there. Please let me know how it goes.

Alex D. Bain email: bain@mcmaster.ca
Department of Chemistry phone: (905) 525-9140 ext 24524
McMaster University fax: (905) 522-2509
1280 Main St. West http://www.chemistry.mcmaster.ca/faculty/bain
Hamilton, Ontario CANADA
L8S 4M1