Benedetta Mennucci, Ph.D.

Affiliations: 
Chemistry University of Pisa, Pisa, Toscana, Italy 
Area:
Theoretical Chemistry
Website:
https://www1.dcci.unipi.it/molecolab/people/prof-benedetta-mennucci/
Google:
"Benedetta Mennucci"
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Publications

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Di Prima D, Pedraza-González L, Reinholdt P, et al. (2025) Fluorescent Rhodopsins: A Challenging Test for Cost-Effective QM/MM Approaches. The Journal of Physical Chemistry. A
Kulkarni C, Gestsson HÓ, Cupellini L, et al. (2025) Theory of photosynthetic membrane influence on B800-B850 energy transfer in the LH2 complex. Biophysical Journal
Nottoli T, Bondanza M, Lipparini F, et al. (2025) A Polarizable CASSCF/MM Approach Using the Interface Between OpenMMPol Library and Cfour. Journal of Computational Chemistry. 46: e27550
Londi G, Salvadori G, Mazzeo P, et al. (2024) Protein-Driven Electron-Transfer Process in a Fatty Acid Photodecarboxylase. Jacs Au. 5: 158-168
John C, Pedraza-González L, Betti E, et al. (2024) A Computational Approach to Modeling Excitation Energy Transfer and Quenching in Light-Harvesting Complexes. The Journal of Physical Chemistry. B
Sheppard D, Espinoza-Corral R, Lechno-Yossef S, et al. (2024) N-terminal domain homologs of the orange carotenoid protein increase quenching of cyanobacterial phycobilisomes. Plant Physiology
Salvadori G, Mennucci B. (2024) Analogies and Differences in the Photoactivation Mechanism of Bathy and Canonical Bacteriophytochromes Revealed by Multiscale Modeling. The Journal of Physical Chemistry Letters. 15: 8078-8084
Saraceno P, Sardar S, Caferri R, et al. (2024) Probing the Effect of Mutations on Light Harvesting in CP29 by Transient Absorption and First-Principles Simulations. The Journal of Physical Chemistry Letters. 6398-6408
Betti E, Saraceno P, Cignoni E, et al. (2024) Insights into Energy Transfer in Light-Harvesting Complex II Through Machine-Learning Assisted Simulations. The Journal of Physical Chemistry. B. 128: 5188-5200
Arcidiacono A, Cignoni E, Mazzeo P, et al. (2024) Predicting Solvatochromism of Chromophores in Proteins through QM/MM and Machine Learning. The Journal of Physical Chemistry. A. 128: 3646-3658
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