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Wong, CY
,
Curutchet C
,
Tretiak S
,
Scholes GD
. 2009.
Ideal dipole approximation fails to predict electronic coupling and energy transfer between semiconducting single-wall carbon nanotubes
.
Journal of Chemical Physics. 130(8)
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V
Viani, L
,
Curutchet C
,
Mennucci B
. 2013.
Spatial and Electronic Correlations in the PE545 Light-Harvesting Complex
.
Journal of Physical Chemistry Letters. 4(3):372-377.
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S
Soteras, I
,
Curutchet C
,
Bidon-Chanal A
,
Dehez F
,
Angyan JG
,
Orozco M
,
Chipot C
,
Luque FJ
. 2007.
Derivation of distributed models of atomic polarizability for molecular Simulations
.
Journal of Chemical Theory and Computation. 3(6):1901-1913.
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Soteras, I
,
Curutchet C
,
Bidon-Chanal A
,
Orozco M
,
Luque FJ
. 2005.
Extension of the MST model to the IEF formalism: HF and B3LYP parametrizations
.
Journal of Molecular Structure-Theochem. 727(1-3):29-40.
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Scholes, GD
,
Curutchet C
,
Mennucci B
,
Cammi R
,
Tomasi J
. 2007.
How solvent controls electronic energy transfer and light harvesting
.
Journal of Physical Chemistry B. 111(25):6978-6982.
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R
Russo, V
,
Curutchet C
,
Mennucci B
. 2007.
Towards a molecular scale interpretation of excitation energy transfer in solvated bichromophoric systems. II. The through-bond contribution
.
Journal of Physical Chemistry B. 111(4):853-863.
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Rondeau-Gagne, S
,
Curutchet C
,
Grenier F
,
Scholes GD
,
Morin J-F
. 2010.
Synthesis, characterization and DFT calculations of new ethynyl-bridged C-60 derivatives
.
Tetrahedron. 66(23):4230-4242.
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N
Novoderezhkin, VI
,
Doust AB
,
Curutchet C
,
Scholes GD
,
van Grondelle R
. 2010.
Excitation Dynamics in Phycoerythrin 545: Modeling of Steady-State Spectra and Transient Absorption with Modified Redfield Theory
.
Biophysical Journal. 99(2):344-352.
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Neugebauer, J
,
Curutchet C
,
Munoz-Losa A
,
Mennucci B
. 2010.
A Subsystem TDDFT Approach for Solvent Screening Effects on Excitation Energy Transfer Couplings
.
Journal of Chemical Theory and Computation. 6(6):1843-1851.
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M
Munoz-Losa, A
,
Curutchet C
,
Fdez Galvan I
,
Mennucci B
. 2008.
Quantum mechanical methods applied to excitation energy transfer: A comparative analysis on excitation energies and electronic couplings
.
Journal of Chemical Physics. 129(3)
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Munoz-Losa, A
,
Curutchet C
,
Krueger BP
,
Hartsell LR
,
Mennucci B
. 2009.
Fretting about FRET: Failure of the Ideal Dipole Approximation
.
Biophysical Journal. 96(12):4779-4788.
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Mirkovic, T
,
Doust AB
,
Kim J
,
Wilk KE
,
Curutchet C
,
Mennucci B
,
Cammi R
,
Curmi PMG
,
Scholes GD
. 2007.
Ultrafast light harvesting dynamics in the cryptophyte phycocyanin 645
.
Photochemical & Photobiological Sciences. 6(9):964-975.
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Mennucci, B
,
Curutchet C
. 2011.
The role of the environment in electronic energy transfer: a molecular modeling perspective
.
Physical Chemistry Chemical Physics. 13(24):11538-11550.
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L
Luque, FJ
,
Curutchet C
,
Munoz-Muriedas J
,
Bidon-Chanal A
,
Soteras I
,
Morreale A
,
Gelpi JL
,
Orozco M
. 2003.
Continuum solvation models: Dissecting the free energy of solvation
.
Physical Chemistry Chemical Physics. 5(18):3827-3836.
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K
Klamt, A
,
Mennucci B
,
Tomasi J
,
Barone V
,
Curutchet C
,
Orozco M
,
Luque FJ
. 2009.
On the Performance of Continuum Solvation Methods. A Comment on "Universal Approaches to Solvation Modeling"
.
Accounts of Chemical Research. 42(4):489-492.
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Kim, J
,
Huxter VM
,
Curutchet C
,
Scholes GD
. 2009.
Measurement of Electron-Electron Interactions and Correlations Using Two-Dimensional Electronic Double-Quantum Coherence Spectroscopy
.
Journal of Physical Chemistry A. 113(44):12122-12133.
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H
Hossein-Nejad, H
,
Curutchet C
,
Kubica A
,
Scholes GD
. 2011.
Delocalization-Enhanced Long-Range Energy Transfer between Cryptophyte Algae PE545 Antenna Proteins
.
Journal of Physical Chemistry B. 115(18):5243-5253.
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Hernandez, B
,
Curutchet C
,
Colominas C
,
Orozco M
,
Luque FJ
. 2002.
Prediction of conformational free energy differences of solutes in solution: An MC-MST study
.
Molecular Simulation. 28(1-2):153-171.
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Hennebicq, E
,
Beljonne D
,
Curutchet C
,
Scholes GD
,
Silbey RJ
. 2009.
Shared-mode assisted resonant energy transfer in the weak coupling regime
.
Journal of Chemical Physics. 130(21)
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C
Curutchet, C
,
Poater J
,
Sola M
,
Elguero J
. 2011.
Analysis of the Effects of N-Substituents on Some Aspects of the Aromaticity of Imidazoles and Pyrazoles
.
Journal of Physical Chemistry A. 115(30):8571-8577.
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Curutchet, C
,
Cramer CJ
,
Truhlar DG
,
Ruiz-Lopez MF
,
Rinaldi D
,
Orozco M
,
Luque FJ
. 2003.
Electrostatic component of solvation: Comparison of SCRF continuum models
.
Journal of Computational Chemistry. 24(3):284-297.
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Curutchet, C
,
Voityuk AA
. 2011.
Triplet-Triplet Energy Transfer in DNA: A Process that Occurs on the Nanosecond Timescale
.
Angewandte Chemie-International Edition. 50(8):1820-1822.
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Curutchet, C
,
Salichs A
,
Barril X
,
Orozco M
,
Luque FJ
. 2003.
Transferability of fragmental contributions to the octanol/water partition coefficient: An NDDO-based MST study
.
Journal of Computational Chemistry. 24(1):32-45.
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Curutchet, C
,
Mennucci B
. 2005.
Toward a molecular scale interpretation of excitation energy transfer in solvated bichromophoric systems
.
Journal of the American Chemical Society. 127(47):16733-16744.
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Curutchet, C
,
Feist FA
,
Van Averbeke B
,
Mennucci B
,
Jacob J
,
Muellen K
,
Basche T
,
Beljonne D
. 2010.
Superexchange-mediated electronic energy transfer in a model dyad
.
Physical Chemistry Chemical Physics. 12(27):7378-7385.
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