Challenges and Advances in Computational Chemistry and Physics, volume 31, pages 271-292
QM/MM Approaches Shed Light on GFP Puzzles
Nemukhin Alexander V
1, 2
,
Grigorenko Bella L
1, 2
Publication type: Book Chapter
Publication date: 2020-10-28
Quartile SCImago
— Quartile WOS
—
Impact factor: —
ISSN: 25424491, 25424483
Abstract
The green fluorescent proteinGreen Fluorescent Protein (GFP) (GFP) is one of the most important light-responsive biological systems. We describe applications of a particular QM/MM version based on the flexible effective fragment potentialEffective fragment potential theory to characterize the properties of this protein including transformations between different forms of GFPGreen Fluorescent Protein (GFP). We also show how the chemical reactions of chromophoreChromophore maturation in GFPGreen Fluorescent Protein (GFP) and the photochemical reactions leading to GFPGreen Fluorescent Protein (GFP) malfunction are characterized in QM/MM simulations.
Citations by journals
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1
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Chemical Physics Reviews
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Chemical Physics Reviews
1 publication, 33.33%
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Wiley Interdisciplinary Reviews: Computational Molecular Science
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Wiley Interdisciplinary Reviews: Computational Molecular Science
1 publication, 33.33%
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Journal of Chemical Theory and Computation
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Journal of Chemical Theory and Computation
1 publication, 33.33%
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1
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Citations by publishers
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1
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American Institute of Physics (AIP)
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American Institute of Physics (AIP)
1 publication, 33.33%
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Wiley
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Wiley
1 publication, 33.33%
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American Chemical Society (ACS)
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American Chemical Society (ACS)
1 publication, 33.33%
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1
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- We do not take into account publications that without a DOI.
- Statistics recalculated only for publications connected to researchers, organizations and labs registered on the platform.
- Statistics recalculated weekly.
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Nemukhin A. V. et al. QM/MM Approaches Shed Light on GFP Puzzles // Challenges and Advances in Computational Chemistry and Physics. 2020. Vol. 31. pp. 271-292.
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Nemukhin A. V., Grigorenko B. L. QM/MM Approaches Shed Light on GFP Puzzles // Challenges and Advances in Computational Chemistry and Physics. 2020. Vol. 31. pp. 271-292.
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TY - GENERIC
DO - 10.1007/978-3-030-57721-6_6
UR - https://doi.org/10.1007%2F978-3-030-57721-6_6
TI - QM/MM Approaches Shed Light on GFP Puzzles
T2 - Challenges and Advances in Computational Chemistry and Physics
AU - Nemukhin, Alexander V
AU - Grigorenko, Bella L
PY - 2020
DA - 2020/10/28 00:00:00
PB - Springer Nature
SP - 271-292
VL - 31
SN - 2542-4491
SN - 2542-4483
ER -
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@incollection{2020_Nemukhin,
author = {Alexander V Nemukhin and Bella L Grigorenko},
title = {QM/MM Approaches Shed Light on GFP Puzzles},
publisher = {Springer Nature},
year = {2020},
volume = {31},
pages = {271--292},
month = {oct}
}
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