Modeling of biomolecular systems with the quantum mechanical and molecular mechanical method based on the effective fragment potential technique: Proposal of flexible fragments
Bella Grigorenko
1
,
Bella L Grigorenko
1
,
Alexander V Nemukhin
1
,
Igor A Topol
1
,
STANLEY K. BURT
1
Publication type: Journal Article
Publication date: 2002-10-16
scimago Q2
wos Q2
SJR: 0.634
CiteScore: 4.8
Impact factor: 2.8
ISSN: 10895639, 15205215
Physical and Theoretical Chemistry
Abstract
Development and applications of a new approach to hybrid quantum mechanical and molecular mechanical (QM/MM) theory based on the effective fragment potential (EFP) technique for modeling properties...
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Metrics
62
Total citations:
62
Citations from 2024:
4
(6.45%)
Cite this
GOST |
RIS |
BibTex |
MLA
Cite this
GOST
Copy
Grigorenko B. et al. Modeling of biomolecular systems with the quantum mechanical and molecular mechanical method based on the effective fragment potential technique: Proposal of flexible fragments // Journal of Physical Chemistry A. 2002. Vol. 106. No. 44. pp. 10663-10672.
GOST all authors (up to 50)
Copy
Grigorenko B., Grigorenko B. L., Nemukhin A., Nemukhin A. V., Topol I. A., BURT S. K. Modeling of biomolecular systems with the quantum mechanical and molecular mechanical method based on the effective fragment potential technique: Proposal of flexible fragments // Journal of Physical Chemistry A. 2002. Vol. 106. No. 44. pp. 10663-10672.
Cite this
RIS
Copy
TY - JOUR
DO - 10.1021/jp026464w
UR - https://pubs.acs.org/doi/10.1021/jp026464w
TI - Modeling of biomolecular systems with the quantum mechanical and molecular mechanical method based on the effective fragment potential technique: Proposal of flexible fragments
T2 - Journal of Physical Chemistry A
AU - Grigorenko, Bella
AU - Grigorenko, Bella L
AU - Nemukhin, Alexander
AU - Nemukhin, Alexander V
AU - Topol, Igor A
AU - BURT, STANLEY K.
PY - 2002
DA - 2002/10/16
PB - American Chemical Society (ACS)
SP - 10663-10672
IS - 44
VL - 106
SN - 1089-5639
SN - 1520-5215
ER -
Cite this
BibTex (up to 50 authors)
Copy
@article{2002_Grigorenko,
author = {Bella Grigorenko and Bella L Grigorenko and Alexander Nemukhin and Alexander V Nemukhin and Igor A Topol and STANLEY K. BURT},
title = {Modeling of biomolecular systems with the quantum mechanical and molecular mechanical method based on the effective fragment potential technique: Proposal of flexible fragments},
journal = {Journal of Physical Chemistry A},
year = {2002},
volume = {106},
publisher = {American Chemical Society (ACS)},
month = {oct},
url = {https://pubs.acs.org/doi/10.1021/jp026464w},
number = {44},
pages = {10663--10672},
doi = {10.1021/jp026464w}
}
Cite this
MLA
Copy
Grigorenko, Bella, et al. “Modeling of biomolecular systems with the quantum mechanical and molecular mechanical method based on the effective fragment potential technique: Proposal of flexible fragments.” Journal of Physical Chemistry A, vol. 106, no. 44, Oct. 2002, pp. 10663-10672. https://pubs.acs.org/doi/10.1021/jp026464w.
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