13C NMR Relaxation Analysis of Protein GB3 for the Assessment of Side Chain Dynamics Predictions by Current AMBER and CHARMM Force Fields

2020 ◽  
Vol 16 (5) ◽  
pp. 2896-2913
Author(s):  
Janet S. Anderson ◽  
Griselda Hernández ◽  
David M. LeMaster
Keyword(s):  
13C Nmr ◽  
Force Fields ◽  
Nmr Relaxation ◽  
Side Chain ◽  
Chain Dynamics ◽  
Relaxation Analysis ◽  
Side Chain Dynamics

Histidine side-chain dynamics and protonation monitored by 13C CPMG NMR relaxation dispersion

2009 ◽  
Vol 44 (4) ◽  
pp. 225-233 ◽  
Author(s):  
Mathias A. S. Hass ◽  
Ali Yilmaz ◽  
Hans E. M. Christensen ◽  
Jens J. Led
Keyword(s):  
Nmr Relaxation ◽  
Relaxation Dispersion ◽  
Side Chain ◽  
Chain Dynamics ◽  
Side Chain Dynamics

scholarly journals NMR Relaxation and Molecular Dynamics Simulations of Side Chain Dynamics in Proteins

2018 ◽  
Vol 114 (3) ◽  
pp. 339a
Author(s):  
Falk Hoffmann ◽  
Mengjun Xue ◽  
Frans Mulder ◽  
Lars Schäfer
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Nmr Relaxation ◽  
Side Chain ◽  
Chain Dynamics ◽  
Dynamics Simulations ◽  
Side Chain Dynamics
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