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@ARTICLE{Calandrini:861355,
author = {Calandrini, Vania and Abergel, Daniel and Kneller, Gerald
R.},
title = {{F}ractional protein dynamics seen by nuclear magnetic
resonance spectroscopy: {R}elating molecular dynamics
simulation and experiment},
journal = {The journal of chemical physics},
volume = {133},
number = {14},
issn = {1089-7690},
address = {Melville, NY},
publisher = {American Institute of Physics},
reportid = {FZJ-2019-01837},
pages = {145101 -},
year = {2010},
abstract = {We propose a fractional Brownian dynamics model for time
correlation functions characterizing the internal dynamics
of proteins probed by NMR relaxation spectroscopy. The time
correlation functions are represented by a broad
distribution of exponential functions which are
characterized by two parameters. We show that the model
describes well the restricted rotational motion of N–H
vectors in the amide groups of lysozyme obtained from
molecular dynamics simulation and that reliable predictions
of experimental relaxation rates can be obtained on that
basis.},
cin = {IAS-5 / INM-9},
ddc = {530},
cid = {I:(DE-Juel1)IAS-5-20120330 / I:(DE-Juel1)INM-9-20140121},
pnm = {899 - ohne Topic (POF3-899)},
pid = {G:(DE-HGF)POF3-899},
typ = {PUB:(DE-HGF)16},
pubmed = {pmid:20950048},
UT = {WOS:000283200400071},
doi = {10.1063/1.3486195},
url = {https://juser.fz-juelich.de/record/861355},
}