RING NMR dynamics: software for analysis of multiple NMR relaxation experiments

被引:0
作者
Martha A. Beckwith
Teddy Erazo-Colon
Bruce A. Johnson
机构
[1] CUNY Advanced Science Research Center,Structural Biology Initiative
来源
Journal of Biomolecular NMR | 2021年 / 75卷
关键词
NMR relaxation; Software; Macromolecular dynamics;
D O I
暂无
中图分类号
学科分类号
摘要
Molecular motions are fundamental to the existence of life, and NMR spectroscopy remains one of the most useful and powerful methods to measure their rates and molecular characteristics. Multiple experimental methods are available for measuring the NMR relaxation properties and these can require different methods for extracting model parameters. We present here a new software application, RING NMR Dynamics, that is designed to support analysis of multiple relaxation types. The initial release of RING NMR Dynamics supports the analysis of exponential decay experiments such as T1 and T2, as well as CEST and R2 and R1ρ relaxation dispersion. The software runs on multiple operating systems in both a command line mode and a user-friendly GUI that allows visualizing and simulating relaxation data. Interaction with another program, NMRFx Analyst, allows drilling down from the derived relaxation parameters to the raw spectral data.
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页码:9 / 23
页数:14
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