Russian Chemical Bulletin, volume 63, issue 8, pages 1703-1709
Computer modeling of components of photoreceptor systems
Nemukhin A. V.
1, 2
,
Khrenova M. G.
1
,
Polyakov I. V.
1
,
Grigorenko B. L.
1, 2
,
Moscovsky A A
1, 2
Publication type: Journal Article
Publication date: 2014-08-01
Journal:
Russian Chemical Bulletin
Quartile SCImago
Q3
Quartile WOS
Q3
Impact factor: 1.7
ISSN: 10665285, 15739171
General Chemistry
Abstract
Computational methods of molecular modeling, including quantum chemistry, molecular dynamics, as well as multilevel quantum mechanics/molecular mechanics (QM/MM) approaches, were applied to study fragments of selected photoreceptor systems. Large-scale molecular systems modeling natural photosynthetic centers and components of prospective solar cells containing titanium dioxide and organic dye molecules were chosen as the most important representatives. It is shown that the modern computational approaches are capable of predicting structures and spectra of such complicated molecular aggregates.
Citations by journals
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Moscow University Chemistry Bulletin
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Moscow University Chemistry Bulletin
1 publication, 100%
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Citations by publishers
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Pleiades Publishing
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Pleiades Publishing
1 publication, 100%
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GOST
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Nemukhin A. V. et al. Computer modeling of components of photoreceptor systems // Russian Chemical Bulletin. 2014. Vol. 63. No. 8. pp. 1703-1709.
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Nemukhin A. V., Khrenova M. G., Polyakov I. V., Grigorenko B. L., Moscovsky A. A. Computer modeling of components of photoreceptor systems // Russian Chemical Bulletin. 2014. Vol. 63. No. 8. pp. 1703-1709.
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TY - JOUR
DO - 10.1007/s11172-014-0656-x
UR - https://doi.org/10.1007%2Fs11172-014-0656-x
TI - Computer modeling of components of photoreceptor systems
T2 - Russian Chemical Bulletin
AU - Nemukhin, A. V.
AU - Khrenova, M. G.
AU - Polyakov, I. V.
AU - Moscovsky, A A
AU - Grigorenko, B. L.
PY - 2014
DA - 2014/08/01 00:00:00
PB - Springer Nature
SP - 1703-1709
IS - 8
VL - 63
SN - 1066-5285
SN - 1573-9171
ER -
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BibTex
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@article{2014_Nemukhin,
author = {A. V. Nemukhin and M. G. Khrenova and I. V. Polyakov and A A Moscovsky and B. L. Grigorenko},
title = {Computer modeling of components of photoreceptor systems},
journal = {Russian Chemical Bulletin},
year = {2014},
volume = {63},
publisher = {Springer Nature},
month = {aug},
url = {https://doi.org/10.1007%2Fs11172-014-0656-x},
number = {8},
pages = {1703--1709},
doi = {10.1007/s11172-014-0656-x}
}
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MLA
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Nemukhin, A. V., et al. “Computer modeling of components of photoreceptor systems.” Russian Chemical Bulletin, vol. 63, no. 8, Aug. 2014, pp. 1703-1709. https://doi.org/10.1007%2Fs11172-014-0656-x.