Browsing by Author Curutchet Barat, Carles E.
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| Issue Date | Title | Author(s) |
|---|---|---|
| 28-Mar-2023 | Benchmarking DFT functionals for photophysics of pyranoflavylium cations | Souza, Jhonathan R.; Curutchet Barat, Carles E.; Aoto, Yuri A.; Homem-de-Mello, Paula |
| 16-Mar-2017 | Can Förster Theory Describe Stereoselective Energy Transfer Dynamics in a Protein-Ligand Complex? | Pinheiro, Silvana de Souza; Curutchet Barat, Carles E. |
| 13-Oct-2015 | Chromophore-Protein Coupling beyond Nonpolarizable Models: Understanding Absorption in Green Fluorescent Protein | Daday, Csaba; Curutchet Barat, Carles E.; Sinicropi, Adalgisa; Mennucci, Benedetta; Filippi, Claudia |
| 13-Mar-2018 | Density-dependent formulation of dispersion−repulsion interactions in hybrid multiscale quantum/molecular mechanics (QM/MM) models | Curutchet Barat, Carles E.; Cupellini, Lorenzo; Kongsted, Jacob; Corni, Stefano; Frediani, Luca; Steindal, Arnfinn Hykkerud; Guido, Ciro A.; Scalmani, Giovanni; Mennucci, Benedetta |
| 30-Jul-2018 | Determination of the protonation preferences of bilin pigments in cryptophyte antenna complexes | Corbella Morató, Marina; Toa, Zi. S. D.; Scholes, Gregory D.; Luque Garriga, F. Xavier; Curutchet Barat, Carles E. |
| 20-Jun-2013 | Dissecting the nature of exciton interactions in ethyne-linked tetraarylporphyrin arrays | Caprasecca, Stefano; Curutchet Barat, Carles E.; Mennucci, Benedetta |
| 25-Oct-2012 | Distance dependence of triplet energy transfer in water and organic solvents: A QM/MD study | Curutchet Barat, Carles E.; Voityuk, Alexander A. |
| 10-Nov-2015 | Electronic Couplings for Resonance Energy Transfer from CCSD Calculations: From Isolated to Solvated Systems | Caricato, Marco; Curutchet Barat, Carles E.; Mennucci, Benedetta; Scalmani, Giovanni |
| 15-Feb-2019 | Electronic energy transfer in biomacromolecules | Cupellini, Lorenzo; Corbella Morató, Marina; Mennucci, Benedetta; Curutchet Barat, Carles E. |
| 27-Oct-2016 | Electrostatic versus Resonance Interactions in Photoreceptor Proteins: The Case of Rhodopsin | Guareschi, Riccardo; Valsson, Omar; Curutchet Barat, Carles E.; Mennucci, Benedetta; Filippi, Claudia |
| 25-Apr-2013 | Energy Flow in the Cryptophyte PE545 Antenna Is Directed by Bilin Pigment Conformation | Curutchet Barat, Carles E.; Novoderezhkin, Vladimir I.; Kongsted, Jacob; Muñoz-Losa, Aurora; Van Grondelle, Rienk; Scholes, Gregory D.; Mennucci, Benedetta |
| 30-Jan-2023 | Engineering excitonically coupled dimers in an artificial protein for light harvesting via computational modeling | Curti, Mariano; Maffeis, Valentin; Teixeira Alves Duarte, Luís Gustavo; Shareef, Saeed; Hallado, Luisa Xiomara; Curutchet Barat, Carles E.; Romero, Elisabet |
| 16-Aug-2011 | Environment effects on triplet-triplet energy transfer in DNA | Curutchet Barat, Carles E.; Voityuk, Alexander A. |
| 25-May-2017 | Estudio del impacto de la polarización electrónica en interacciones biomoleculares | Pinheiro, Silvana de Souza |
| 28-Jan-2005 | Estudio teórico de efectos del entorno en sistemas químicos | Curutchet Barat, Carles E. |
| 2014 | Experiència de flexibilitat metodològica en el procés d'ensenyament-aprenentatge. El cas de l'assignatura del grau de Farmàcia 'Biomembranes: estudis fisicoquímics' | Pujol Cubells, Montserrat; Borrell Hernández, Jordi; Curutchet Barat, Carles E.; Domènech Cabrera, Òscar; García López, María Luisa; González Mira, Elisabet; Ortiz Rodrigo, Alba; Sabaté Lagunas, Raimon |
| 8-Apr-2014 | Geometry Optimization in Polarizable QM/MM Models: The Induced Dipole Formulation | Caprasecca, Stefano; Jurinovich, Sandro; Viani, Lucas; Curutchet Barat, Carles E.; Mennucci, Benedetta |
| 21-Sep-2018 | How abasic sites impact hole transfer dynamics in GC-rich DNA sequences | Corbella Morató, Marina; Voityuk, Alexander A.; Curutchet Barat, Carles E. |
| 23-Jan-2017 | Impact of electronic fluctuations and their description on the exciton dynamics in the light-harvesting complex PE545 | Aghtar, Mortaza; Kleinekathöfer, Ulrich; Curutchet Barat, Carles E.; Mennucci, Benedetta |
| 25-Jul-2018 | Modelització multiescala del paper de l’entorn en processos de transferència de càrrega i d’energia en biomolècules | Corbella Morató, Marina |