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/vufind/Search/Results?lookfor=%22Kurnikov%2C+Igor+V%22&type=Person&sort=year
/vufind/Search/Results?lookfor=%22Kurnikov%2C+Igor+V%22&type=Person&sort=year
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PubPharm (47)
1
Neural Network Corrections to Intermolecular Interaction Terms of a Molecular Force Field Capture Nuclear Quantum Effects in Calculations of Liquid Thermodynamic Properties
enthalten in:
Journal of chemical theory and computation
| 2024
von
Kurnikov, I.
|
Pereyaslavets, L.
|
Kamath, G.
| +14
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2
Combining Force Fields and Neural Networks for an Accurate Representation of Bonded Interactions
enthalten in:
The journal of physical chemistry. A
| 2024
von
Kamath, G.
|
Illarionov, A.
|
Sakipov, S.
| +16
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3
Combining Force Fields and Neural Networks for an Accurate Representation of Chemically Diverse Molecular Interactions
enthalten in:
Journal of the American Chemical Society
| 2023
von
Illarionov, A.
|
Sakipov, S.
|
Pereyaslavets, L.
| +18
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4
Harnessing the Substrate Promiscuity of Dioxygenase AsqJ and Developing Efficient Chemoenzymatic Synthesis for Quinolones
enthalten in:
ACS catalysis
| 2021
von
Tang, H.
|
Tang, Y.
|
Kurnikov, I.
| +5
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5
Epoxidation Catalyzed by the Nonheme Iron(II)- and 2-Oxoglutarate-Dependent Oxygenase, AsqJ : Mechanistic Elucidation of Oxygen Atom Transfer by a Ferryl Intermediate
enthalten in:
Journal of the American Chemical Society
| 2020
von
Li, J.
|
Liao, H.
|
Tang, Y.
| +9
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6
Modeling Electronic Polarizability Changes in the Course of a Magnesium Ion Water Ligand Exchange Process
enthalten in:
The journal of physical chemistry. B
| 2015
von
Kurnikov, I.
|
Kurnikova, M.
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7
Donor/acceptor coupling shortcuts in electron transfer within ruthenium-modified derivatives of cytochrome b(562)
enthalten in:
The journal of physical chemistry. B
| 2015
von
Prytkova, T.
|
Shunaev, V.
|
Glukhova, O.
| +1
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8
Control of cytochrome c redox reactivity through off-pathway modifications in the protein hydrogen-bonding network
enthalten in:
Chemical communications (Cambridge, England)
| 2014
von
Gu, J.
|
Yang, S.
|
Rajic, A.
| +3
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9
A glance at the reactivity of osma(II)cycles [Os(C-N)x(bpy)3-x](m+) (x=0-3) Covering a 1.8 V potential range toward peroxidase through Monte Carlo Simulations ((-)C-N=o-2-phenylpyridinato, bpy=2,2'-bipyridine)
enthalten in:
Journal of inorganic biochemistry
| 2014
von
Cerón-Camacho, R.
|
Le Lagadec, R.
|
Kurnikov, I.
| +1
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10
A glance at the reactivity of osma(II)cycles [Os(C–N) x (bpy)3− x ]m+ (x =0–3) Covering a 1.8V Potential Range toward Peroxidase through Monte Carlo Simulations (−C–N= o-2-phenylpyridinato, bpy=2,2′-bipyridine)
enthalten in:
Journal of inorganic biochemistry
| 2014
von
Cerón-Camacho, R.
|
Le Lagadec, R.
|
Kurnikov, I.
| +1
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Thema
27
Journal Article
15
Research Support, Non-U.S. Gov't
12
Research Support, N.I.H., Extramural
10
9007-43-6
10
Cytochromes c
7
Cardiolipins
6
Research Support, U.S. Gov't, Non-P.H.S.
6
Research Support, U.S. Gov't, P.H.S.
5
42VZT0U6YR
5
7UI0TKC3U5
5
Heme
5
Ruthenium
4
6PLQ3CP4P3
4
E1UOL152H7
4
Etoposide
4
Iron
4
Oxygen
4
S88TT14065
3
Myoglobin
3
Peroxidase
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Erscheinungszeitraum
44
2000-
3
1900-1999
Erscheinungsjahr(e)
Von:
Bis:
Sprache
29
Englisch
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