Browsing by Author Curutchet Barat, Carles E.

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Issue DateTitleAuthor(s)
16-Mar-2017Can Förster Theory Describe Stereoselective Energy Transfer Dynamics in a Protein-Ligand Complex?Pinheiro, Silvana de Souza; 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
13-Mar-2018Density-dependent formulation of dispersion−repulsion interactions in hybrid multiscale quantum/molecular mechanics (QM/MM) modelsCurutchet Barat, Carles E.; Cupellini, Lorenzo; Kongsted, Jacob; Corni, Stefano; Frediani, Luca; Steindal, Arnfinn Hykkerud; Guido, Ciro A.; Scalmani, Giovanni; Mennucci, Benedetta
30-Jul-2018Determination of the protonation preferences of bilin pigments in cryptophyte antenna complexesCorbella Morató, Marina; Toa, Zi. S. D.; Scholes, Gregory D.; Luque Garriga, F. Xavier; Curutchet Barat, Carles E.
20-Jun-2013Dissecting the nature of exciton interactions in ethyne-linked tetraarylporphyrin arraysCaprasecca, Stefano; Curutchet Barat, Carles E.; Mennucci, Benedetta
25-Oct-2012Distance dependence of triplet energy transfer in water and organic solvents: A QM/MD studyCurutchet Barat, Carles E.; Voityuk, Alexander A.
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
15-Feb-2019Electronic energy transfer in biomacromoleculesCupellini, Lorenzo; Corbella Morató, Marina; Mennucci, Benedetta; Curutchet Barat, Carles E.
27-Oct-2016Electrostatic versus Resonance Interactions in Photoreceptor Proteins: The Case of RhodopsinGuareschi, Riccardo; Valsson, Omar; Curutchet Barat, Carles E.; Mennucci, Benedetta; Filippi, Claudia
25-Apr-2013Energy Flow in the Cryptophyte PE545 Antenna Is Directed by Bilin Pigment ConformationCurutchet Barat, Carles E.; Novoderezhkin, Vladimir I.; Kongsted, Jacob; Muñoz-Losa, Aurora; Van Grondelle, Rienk; Scholes, Gregory D.; Mennucci, Benedetta
16-Aug-2011Environment effects on triplet-triplet energy transfer in DNACurutchet Barat, Carles E.; Voityuk, Alexander A.
25-May-2017Estudio del impacto de la polarización electrónica en interacciones biomolecularesPinheiro, Silvana de Souza
28-Jan-2005Estudio teórico de efectos del entorno en sistemas químicosCurutchet Barat, Carles E.
2014Experiència 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-2014Geometry Optimization in Polarizable QM/MM Models: The Induced Dipole FormulationCaprasecca, Stefano; Jurinovich, Sandro; Viani, Lucas; Curutchet Barat, Carles E.; Mennucci, Benedetta
21-Sep-2018How abasic sites impact hole transfer dynamics in GC-rich DNA sequencesCorbella Morató, Marina; Voityuk, Alexander A.; Curutchet Barat, Carles E.
23-Jan-2017Impact of electronic fluctuations and their description on the exciton dynamics in the light-harvesting complex PE545Aghtar, Mortaza; Kleinekathöfer, Ulrich; Curutchet Barat, Carles E.; Mennucci, Benedetta
25-Jul-2018Modelització multiescala del paper de l’entorn en processos de transferència de càrrega i d’energia en biomolèculesCorbella Morató, Marina
14-Aug-2014Molecular basis of the exciton-phonon interactions in the PE545 light-harvesting complexViani, Lucas; Corbella Morató, Marina; Curutchet Barat, Carles E.; O'Reilly, Edward J.; Olaya-Castro, Alexandra; Mennucci, Benedetta
19-Feb-2020On the Binding of Congo Red to Amyloid FibrilsEspargaró Colomé, Alba; Llabrés Prat, Salomé; Saupe, Sven J.; Curutchet Barat, Carles E.; Luque Garriga, F. Xavier; Sabaté Lagunas, Raimon