Publicacións nas que colabora con Luis Manuel Frutos Gaite (9)

2019

  1. Photosensitized Retinal Isomerization in Rhodopsin Mediated by a Triplet State

    ChemPhotoChem, Vol. 3, Núm. 9, pp. 925-932

  2. Mechanochemical Improvement of Norbornadiene-Based Molecular Solar-Thermal Systems Performance

    ACS Sustainable Chemistry and Engineering, Vol. 7, Núm. 24, pp. 19496-19504

2014

  1. Toward an optomechanical control of photoswitches by tuning their spectroscopical properties: Structural and dynamical insights into Azobenzene

    Journal of Chemical Theory and Computation, Vol. 10, Núm. 1, pp. 312-323

  2. Definition and determination of the triplet-triplet energy transfer reaction coordinate

    Journal of Chemical Physics, Vol. 140, Núm. 3

2012

  1. Structural substituent effect in the excitation energy of a chromophore: Quantitative determination and application to S-nitrosothiols

    Journal of Chemical Theory and Computation, Vol. 8, Núm. 9, pp. 3293-3302

  2. Photostability mechanisms in human γb-crystallin: Role of the tyrosine corner unveiled by quantum mechanics and hybrid quantum mechanics/molecular mechanics methodologies

    Journal of Chemical Theory and Computation, Vol. 8, Núm. 4, pp. 1351-1359

  3. Modulating nitric oxide release by S-nitrosothiol photocleavage: Mechanism and substituent effects

    Journal of Physical Chemistry A, Vol. 116, Núm. 26, pp. 7039-7049

2011

  1. First principles study of photostability within hydrogen-bonded amino acids

    Physical Chemistry Chemical Physics

2010

  1. Photoinduced proton transfer as a possible mechanism for highly efficient excited-state deactivation in proteins

    Journal of Physical Chemistry Letters, Vol. 1, Núm. 1, pp. 425-428