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Structure of the Alanine Hydration Shell as Probed by NMR Chemical Shifts and Indirect Spin-Spin Coupling
- 1.0332605 - ÚOCHB 2010 RIV US eng J - Journal Article
Dračínský, Martin - Kaminský, Jakub - Bouř, Petr
Structure of the Alanine Hydration Shell as Probed by NMR Chemical Shifts and Indirect Spin-Spin Coupling.
Journal of Physical Chemistry B. Roč. 113, č. 44 (2009), s. 14698-14707. ISSN 1520-6106. E-ISSN 1520-5207
R&D Projects: GA ČR GA202/07/0732; GA AV ČR IAA400550702
Institutional research plan: CEZ:AV0Z40550506
Keywords : NMR spectroscopy * CPMD * molecular dynamics * solvent effects
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 3.471, year: 2009
Structure of the Alanine Hydration Shell was deduced from the NMR Chemical Shifts and Indirect Spin-Spin Coupling constants. They were measured in various pH an theoretically modeled.
Permanent Link: http://hdl.handle.net/11104/0005547
Number of the records: 1