A FAST ALGORITHM FOR COMPUTER-SIMULATIONS IN INEPT EXPERIMENTS

Authors
LARTIGUE JC PETRAUD M HARKET M DEJESO B RATIER M
Citation
Jc. Lartigue et al., A FAST ALGORITHM FOR COMPUTER-SIMULATIONS IN INEPT EXPERIMENTS, Computers & chemistry, 20(2), 1996, pp. 219-226
Citations number
11
Categorie Soggetti
Computer Application, Chemistry & Engineering",Chemistry,"Computer Science Interdisciplinary Applications
Journal title
Computers & chemistry → ACNP
ISSN journal
00978485
Volume
20
Issue
2
Year of publication
1996
Pages
219 - 226
Database
ISI
SICI code
0097-8485(1996)20:2<219:AFAFCI>2.0.ZU;2-L
Abstract
A rapid, convenient and portable computer simulation program based on the general INEPT equations is described. It allows an easy calculatio n of the spectra for any weakly coupled structure up to nine systems o f spins-1/2 [ca 25 spins] and an optimization of the experimental pola rization and refocusing time parameters.