Publications by authors named "Chiara Sepali"

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Fully Atomistic Modeling in Computational Spectroscopy: Tryptophan in Aqueous Solution as a Test Case.
Marco Trinari, Chiara Sepali, Tommaso Giovannini, Chiara Cappelli

J Phys Chem A· November 2025

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Fully Polarizable Multiconfigurational Self-Consistent Field/Fluctuating Charges Approach.
Chiara Sepali, Linda Goletto, Piero Lafiosca, Matteo Rinaldi, Tommaso Giovannini

J Chem Theory Comput· November 2024

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Computational Spectroscopy of Aqueous Solutions: The Underlying Role of Conformational Sampling.
Chiara Sepali, Sara Gómez, Emanuele Grifoni, Tommaso Giovannini, Chiara Cappelli

J Phys Chem B· May 2024

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Effective fully polarizable QM/MM approaches to compute Raman and Raman Optical Activity spectra in aqueous solution.
Chiara Sepali, Piero Lafiosca, Sara Gómez, Tommaso Giovannini, Chiara Cappelli

Spectrochim Acta A Mol Biomol Spectrosc· January 2024

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