Publications dans lesquelles il/elle collabore avec Daniel Roca Sanjuán (5)

2013

  1. Proton/hydrogen transfer mechanisms in the guanine-cytosine base pair: Photostability and tautomerism

    Journal of Chemical Theory and Computation, Vol. 9, Núm. 1, pp. 481-496

  2. Towards the understanding at the molecular level of the structured-water absorption and fluorescence spectra: A fingerprint of π-stacked water

    Molecular Physics, Vol. 111, Núm. 9-11, pp. 1308-1315

2010

  1. Modeling hole transfer in DNA. II. Molecular basis of charge transport in the DNA chain

    Theoretical Chemistry Accounts, Vol. 126, Núm. 3, pp. 177-183

2009

  1. DNA nucleobase properties and photoreactivity: Modeling environmental effects

    Pure and Applied Chemistry

  2. Toward understanding the photochemistry of photoactive yellow protein: A CASPT2/CASSCF and quantum theory of atoms in molecules combined study of a model chromophore in vacuo

    Journal of Chemical Theory and Computation, Vol. 5, Núm. 11, pp. 3032-3038