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The functional form of the karplus equation

โœ Scribed by K.G.R Pachler


Publisher
Elsevier Science
Year
1972
Weight
324 KB
Volume
8
Category
Article
ISSN
0022-2364

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๐Ÿ“œ SIMILAR VOLUMES


An empirical extension of the karplus eq
โœ Keisuke Imai; Eiji ลŒsawa ๐Ÿ“‚ Article ๐Ÿ“… 1990 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 807 KB

## Abstract The Karplus equation is expanded to contain 11 mutually independent structural terms and 22 adjustable parameters. These terms are selected on an empirical basis and combined linearly (Eqn 4). The new equation reproduces 198 NMR vicinal ^1^Hโ€^1^H coupling constants determined in less po

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## Abstract Analysis of the Vorontsova calculation of vicinal coupling constants in terms of angular and chemical shift dependence indicates some serious inconsistencies in this equation.

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