Interpretation of the Longitudinal 13C Nuclear Spin Relaxation and Chemical Shift Data for Five Bromoazaheterocycles Supported by Nonrelativistic and Relativistic DFT Calculations

Artur Wodyński; Anna Kraska-Dziadecka; Dominika Kubica; Adam Gryff-Keller

doi:10.1021/jp510687x

Interpretation of the Longitudinal 13C Nuclear Spin Relaxation and Chemical Shift Data for Five Bromoazaheterocycles Supported by Nonrelativistic and Relativistic DFT Calculations

The Journal of Physical Chemistry A ◽

10.1021/jp510687x ◽

2015 ◽

Vol 119 (3) ◽

pp. 517-524 ◽

Cited By ~ 1

Author(s):

Artur Wodyński ◽

Anna Kraska-Dziadecka ◽

Dominika Kubica ◽

Adam Gryff-Keller

Keyword(s):

Chemical Shift ◽

Dft Calculations ◽

Spin Relaxation ◽

Nuclear Spin ◽

Nuclear Spin Relaxation ◽

Relativistic Dft ◽

Chemical Shift Data ◽

Shift Data

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Nuclear spin relaxation due to chemical shift anisotropy of gas-phase 129Xe

Physical Chemistry Chemical Physics ◽

10.1039/c1cp21322a ◽

2011 ◽

Vol 13 (30) ◽

pp. 13704 ◽

Cited By ~ 12

Author(s):

Matti Hanni ◽

Perttu Lantto ◽

Juha Vaara

Keyword(s):

Chemical Shift ◽

Gas Phase ◽

Spin Relaxation ◽

Nuclear Spin ◽

Chemical Shift Anisotropy ◽

Nuclear Spin Relaxation

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The use of interference terms to separate dipolar and chemical-shift anisotropy contributions to nuclear spin relaxation

Journal of Magnetic Resonance (1969) ◽

10.1016/0022-2364(87)90137-5 ◽

1987 ◽

Vol 71 (1) ◽

pp. 151-153 ◽

Cited By ~ 1

Author(s):

L.G Werbelow

Keyword(s):

Chemical Shift ◽

Spin Relaxation ◽

Nuclear Spin ◽

Chemical Shift Anisotropy ◽

Nuclear Spin Relaxation

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Chemical Shift Anisotropy of Imino15N Nuclei in Watson−Crick Base Pairs from Magic Angle Spinning Liquid Crystal NMR and Nuclear Spin Relaxation

Journal of the American Chemical Society ◽

10.1021/ja903244s ◽

2009 ◽

Vol 131 (27) ◽

pp. 9490-9491 ◽

Cited By ~ 17

Author(s):

Alexander Grishaev ◽

Lishan Yao ◽

Jinfa Ying ◽

Arthur Pardi ◽

Ad Bax

Keyword(s):

Liquid Crystal ◽

Chemical Shift ◽

Spin Relaxation ◽

Nuclear Spin ◽

Chemical Shift Anisotropy ◽

Magic Angle Spinning ◽

Nuclear Spin Relaxation ◽

Magic Angle ◽

Base Pairs ◽

Angle Spinning

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Fluorotyrosine alkaline phosphatase: Internal mobility of individual tyrosines and the role of chemical shift anisotropy as a 19F nuclear spin relaxation mechanism in proteins

Journal of Molecular Biology ◽

10.1016/s0022-2836(75)80105-7 ◽

1975 ◽

Vol 98 (1) ◽

pp. 121-153 ◽

Cited By ~ 180

Author(s):

William E. Hull ◽

Brian D. Sykes

Keyword(s):

Alkaline Phosphatase ◽

Chemical Shift ◽

Spin Relaxation ◽

Nuclear Spin ◽

Chemical Shift Anisotropy ◽

Relaxation Mechanism ◽

Nuclear Spin Relaxation ◽

Internal Mobility

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High temperature behavior of the chemical shift and nuclear spin relaxation of Se77 in solid selenium

Solid State Communications ◽

10.1016/0038-1098(80)90298-7 ◽

1980 ◽

Vol 33 (9) ◽

pp. 993-995 ◽

Cited By ~ 8

Author(s):

O. Kanert ◽

R. Küchler ◽

J. Recktenwald

Keyword(s):

High Temperature ◽

Chemical Shift ◽

Spin Relaxation ◽

Nuclear Spin ◽

Temperature Behavior ◽

Nuclear Spin Relaxation ◽

High Temperature Behavior

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NUCLEAR SPIN RELAXATION AND ATOMIC MOTION OF 3He ADSORBED ON GRAFOIL

Le Journal de Physique Colloques ◽

10.1051/jphyscol:19786125 ◽

1978 ◽

Vol 39 (C6) ◽

pp. C6-281-C6-282 ◽

Cited By ~ 1

Author(s):

K. Satō ◽

T. Sugawara

Keyword(s):

Spin Relaxation ◽

Nuclear Spin ◽

Atomic Motion ◽

Nuclear Spin Relaxation

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Nuclear spin relaxation and correlated diffusion of impurities

Le Journal de Physique Colloques ◽

10.1051/jphyscol:1980663 ◽

1980 ◽

Vol 41 (C6) ◽

pp. C6-249-C6-251 ◽

Cited By ~ 2

Author(s):

K. D. Becker

Keyword(s):

Spin Relaxation ◽

Nuclear Spin ◽

Nuclear Spin Relaxation ◽

Diffusion Of Impurities

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Faculty Opinions recommendation of Consistent blind protein structure generation from NMR chemical shift data.

Faculty Opinions – Post-Publication Peer Review of the Biomedical Literature ◽

10.3410/f.1103520.560739 ◽

2008 ◽

Author(s):

Gottfried Otting

Keyword(s):

Protein Structure ◽

Chemical Shift ◽

Nmr Chemical Shift ◽

Structure Generation ◽

Chemical Shift Data ◽

Shift Data

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Using molecular dynamics trajectories to predict nuclear spin relaxation behaviour in large spin systems

Journal of Magnetic Resonance ◽

10.1016/j.jmr.2020.106891 ◽

2020 ◽

pp. 106891

Author(s):

Ilya Kuprov ◽

Laura C. Morris ◽

John N. Glushka ◽

James H. Prestegard

Keyword(s):

Molecular Dynamics ◽

Spin Relaxation ◽

Nuclear Spin ◽

Spin Systems ◽

Nuclear Spin Relaxation ◽

Relaxation Behaviour ◽

Large Spin

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On the theory of electron and nuclear spin relaxation in paramagnetic transition metal complexes

Molecular Physics ◽

10.1080/00268978000102351 ◽

1980 ◽

Vol 40 (6) ◽

pp. 1379-1387 ◽

Cited By ~ 1

Author(s):

Kerwyn M. Kleinschmidt ◽

John F. Dobson ◽

David M. Doddrell

Keyword(s):

Transition Metal ◽

Metal Complexes ◽

Transition Metal Complexes ◽

Spin Relaxation ◽

Nuclear Spin ◽

Nuclear Spin Relaxation

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