| Anharmonic vibrational eigenfunctions and infrared spectra from semiclassical molecular dynamics M Micciarelli, R Conte, J Suarez, M Ceotto The Journal of chemical physics 149 (6), 064115, 2018 | 40 | 2018 |
| An effective semiclassical approach to IR spectroscopy M Micciarelli, F Gabas, R Conte, M Ceotto The Journal of chemical physics 150 (18), 184113, 2019 | 35 | 2019 |
| Nonlinear protein–nucleic acid crosslinking induced by femtosecond UV laser pulses in living cells C Altucci, A Nebbioso, R Benedetti, R Esposito, V Carafa, M Conte, ... Laser Physics Letters 9 (3), 234, 2012 | 31 | 2012 |
| Pushing the frontiers of first-principles based computer simulations of chemical and biological systems E Brunk, N Ashari, P Athri, P Campomanes, FF de Carvalho, ... CHIMIA International Journal for Chemistry 65 (9), 667-671, 2011 | 27 | 2011 |
| Unraveling the molecular mechanisms of color expression in anthocyanins M Rusishvili, L Grisanti, S Laporte, M Micciarelli, M Rosa, RJ Robbins, ... Physical Chemistry Chemical Physics 21 (17), 8757-8766, 2019 | 23 | 2019 |
| Photophysics and Photochemistry of a DNA–Protein Cross-Linking Model: A Synergistic Approach Combining Experiments and Theory M Micciarelli, M Valadan, B Della Ventura, G Di Fabio, L De Napoli, ... The Journal of Physical Chemistry B 118 (19), 4983-4992, 2014 | 21 | 2014 |
| Low-lying excited-states of 5-benzyluracil M Micciarelli, C Altucci, B Della Ventura, R Velotta, V Toşa, ABG Pérez, ... Physical Chemistry Chemical Physics 15 (19), 7161-7173, 2013 | 17 | 2013 |
| Sampling Molecular Conformers in Solution with Quantum Mechanical Accuracy at a Nearly Molecular-Mechanics Cost M Rosa, M Micciarelli, A Laio, S Baroni Journal of chemical theory and computation 12 (9), 4385-4389, 2016 | 16 | 2016 |
| Characterization of the Photochemical Properties of 5-Benzyluracil via Time-Dependent Density Functional Theory M Micciarelli, BFE Curchod, S Bonella, C Altucci, M Valadan, ... The Journal of Physical Chemistry A 121 (20), 3909-3917, 2017 | 14 | 2017 |
| Multimodel Approach to the Optical Properties of Molecular Dyes in Solution I Timrov, M Micciarelli, M Rosa, A Calzolari, S Baroni Journal of chemical theory and computation 12 (9), 4423-4429, 2016 | 14 | 2016 |
| Model system approach to the study of UV induced DNA-proteins crosslink reactions M Micciarelli, C Altucci, I Tavernelli | | |
