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Mennucci, Benedetta
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1

Deciphering Photoreceptors Through Atomistic Modeling from ..:

Salvadori, Giacomo ; Mazzeo, Patrizia ; Accomasso, Davide..
Journal of Molecular Biology.  436 (2024)  5 - p. 168358 , 2024
Link: https://doi.org/10.1016/..
 
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2

Predicting Solvatochromism of Chromophores in Proteins thro..:

Arcidiacono, Amanda ; Cignoni, Edoardo ; Mazzeo, Patrizia..
The Journal of Physical Chemistry A.  128 (2024)  18 - p. 3646-3658 , 2024
Link: https://doi.org/10.1021/..
 
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3

Probing the Effect of Mutations on Light Harvesting in CP29..:

Saraceno, Piermarco ; Sardar, Samim ; Caferri, Roberto...
The Journal of Physical Chemistry Letters.  15 (2024)  24 - p. 6398-6408 , 2024
Link: https://doi.org/10.1021/..
 
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4

Electronic Excited States from Physically Constrained Machi..:

Cignoni, Edoardo ; Suman, Divya ; Nigam, Jigyasa...
ACS Central Science.  10 (2024)  3 - p. 637-648 , 2024
Link: https://doi.org/10.1021/..
 
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5

The OpenMMPol library for polarizable QM/MM calculations of..:

Bondanza, Mattia ; Nottoli, Tommaso ; Nottoli, Michele...
The Journal of Chemical Physics.  160 (2024)  13 - p. , 2024
Link: https://doi.org/10.1063/..
 
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6

Unraveling Water Solvation Effects with Quantum Mechanics/M..:

Moscato, Davide ; Mandelli, Giacomo ; Bondanza, Mattia...
Journal of the American Chemical Society.  146 (2024)  12 - p. 8179-8188 , 2024
Link: https://doi.org/10.1021/..
 
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7

Insights into Energy Transfer in Light-Harvesting Complex I..:

Betti, Elena ; Saraceno, Piermarco ; Cignoni, Edoardo..
The Journal of Physical Chemistry B.  128 (2024)  21 - p. 5188-5200 , 2024
Link: https://doi.org/10.1021/..
 
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8

The nature of carotenoid S* state and its role in the nonph..:

Accomasso, Davide ; Londi, Giacomo ; Cupellini, Lorenzo.
Nature Communications.  15 (2024)  1 - p. , 2024
Link: https://doi.org/10.1038/..
 
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9

Ultrafast excited-state dynamics of Luteins in the major li..:

Pedraza-González, Laura ; Accomasso, Davide ; Cupellini, Lorenzo..
Photochemical & Photobiological Sciences.  23 (2023)  2 - p. 303-314 , 2023
Link: https://doi.org/10.1007/..
 
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10

Machine Learning Exciton Hamiltonians in Light-Harvesting C..:

Cignoni, Edoardo ; Cupellini, Lorenzo ; Mennucci, Benedetta
Journal of Chemical Theory and Computation.  19 (2023)  3 - p. 965-977 , 2023
Link: https://doi.org/10.1021/..
 
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11

How orange carotenoid protein controls the excited state dy..:

Arcidiacono, Amanda ; Accomasso, Davide ; Cupellini, Lorenzo.
Chemical Science.  14 (2023)  40 - p. 11158-11169 , 2023
Link: https://doi.org/10.1039/..
 
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12

Integrated Computational Study of the Light-Activated Struc..:

Hashem, Shaima ; Alteri, Giovanni Battista ; Cupellini, Lorenzo.
The Journal of Physical Chemistry A.  127 (2023)  23 - p. 5065-5074 , 2023
Link: https://doi.org/10.1021/..
 
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13

QM/AMOEBA description of properties and dynamics of embedde..:

Nottoli, Michele ; Bondanza, Mattia ; Mazzeo, Patrizia...
WIREs Computational Molecular Science.  13 (2023)  6 - p. , 2023
Link: https://doi.org/10.1002/..
 
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14

Origin of Low-Lying Red States in the Lhca4 Light-Harvestin..:

Sláma, Vladislav ; Cupellini, Lorenzo ; Mascoli, Vincenzo...
The Journal of Physical Chemistry Letters.  14 (2023)  37 - p. 8345-8352 , 2023
Link: https://doi.org/10.1021/..
 
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15

How the pH Controls Photoprotection in the Light-Harvesting..:

Pedraza-González, Laura ; Cignoni, Edoardo ; D'Ascenzi, Jacopo..
Journal of the American Chemical Society.  145 (2023)  13 - p. 7482-7494 , 2023
Link: https://doi.org/10.1021/..
 
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