title: Molecular dynamics of water in foods and related model systems: multinuclear spin relaxation studies and comparison with theoretical calculations.
abstract: A review of recent studies of molecular dynamics of water in foods and model systems is presented, and the theoretical results are compared with experimental data obtained by several techniques. Both theoretical and experimental approaches are discussed for electrolytes, carbohydrates, and food proteins in solution. Theoretical results from Monte Carlo simulations are compared with experimental NMR relaxation data for quadrupolar nuclei such as those of deuterium and oxygen-17. Hydration studies of wheat, soybean, corn, and myofibrillar proteins by multinuclear spin relaxation techniques are discussed, and several new approaches to the analysis of the experimental data are considered. Correlation times of water motions in hydrated food systems are determined from NMR and dielectric relaxation data. The values of the correlation times for dilute solutions of electrolytes and carbohydrates estimated by NMR are in good agreement with those calculated from dielectric relaxation data, but seem to differ significantly from those proposed from Monte Carlo simulations. Several new and important results concerning the hydration of potato and cereal starches are presented, showing the very different hydration behaviors of these two major groups of starches. The combination of molecular dynamics computations with NMR relaxation techniques will hopefully stimulate novel technological developments in food engineering based on such fundamental studies.
authors.affiliation: University of Illinois, Urbana.
authors.forename: I C
authors.initials: IC
authors.lastname: Baianu
authors.forename: T F
authors.initials: TF
authors.lastname: Kumosinski
authors.forename: P J
authors.initials: PJ
authors.lastname: Bechtel
authors.forename: A
authors.initials: A
authors.lastname: Mora
authors.forename: L T
authors.initials: LT
authors.lastname: Kakalis
authors.forename: P
authors.initials: P
authors.lastname: Yakubu
authors.forename: P
authors.initials: P
authors.lastname: Myers-Betts
authors.forename: T C
authors.initials: TC
authors.lastname: Wei
mesh_terms: D002241:Carbohydrates / Q000737:chemistry; D055598:Chemical Phenomena; D002627:Chemistry, Physical; D005502:Food; D009682:Magnetic Resonance Spectroscopy; D008958:Models, Molecular; D011506:Proteins / Q000737:chemistry; D014867:Water / Q000737:chemistry*
chemical_list: D002241:Carbohydrates; D011506:Proteins; D014867:Water