1. Dipòsit Digital de la Universitat de Barcelona

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Issue DateTitleAuthor(s)
10-Nov-2015Electronic Couplings for Resonance Energy Transfer from CCSD Calculations: From Isolated to Solvated SystemsCaricato, Marco; Curutchet Barat, Carles E.; Mennucci, Benedetta; Scalmani, Giovanni
2-Sep-2015Single Amino Acid Mutation Controls Hole Transfer Dynamics in DNA-Methyltransferase HhaI ComplexesCorbella Morató, Marina; Voityuk, Alexander A.; Curutchet Barat, Carles E.
20-Feb-2015Polarizable QM/MM Multiconfiguration Self-Consistent Field Approach with State-Specific Corrections: Environment Effects on Cytosine Absorption SpectrumLi, Quansong; Mennucci, Benedetta; Robb, Michael A.; Blancafort, Lluís; Curutchet Barat, Carles E.
13-Oct-2015Chromophore-Protein Coupling beyond Nonpolarizable Models: Understanding Absorption in Green Fluorescent ProteinDaday, Csaba; Curutchet Barat, Carles E.; Sinicropi, Adalgisa; Mennucci, Benedetta; Filippi, Claudia
8-Dec-2015Theoretical characterization of the spectral density of the water-soluble chlorophyll-binding protein from combined quantum mechanics/molecular mechanics molecular dynamics simulationsRosnik, Andreana M. R; Curutchet Barat, Carles E.

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