Victor Guallar Tasies

2017

• Exploring Binding Mechanisms in Nuclear Hormone Receptors by Monte Carlo and X-ray-derived Motions

  Biophysical Journal

  C. Grebner, D. Lecina, V. Gil, J. Ulander, P. Hansson, A. Dellsen, C. Tyrchan, K. Edman, A. Hogner, and V. Guallar
• Physics-Based Visual Characterization of Molecular Interaction Forces

  IEEE Transactions on Visualization and Computer Graphics

  P. Hermosilla, J. Estrada, V. Guallar, T. Ropinski, A. Vinacua, and P-P. Vázquez

2016

• Re-designing the substrate binding pocket of laccase for enhanced oxidation of sinapic acid

  Catalysis Science & Technology

  I.. Pardo, L. Santus, P.. Gentili, F.. Lucas, E.. Monza, F.. J. Medrano, C.. Galli, A.. T. Martínez, V. Guallar, and S.. Camarero
• Asymmetric sulfoxidation by engineering the heme pocket of a dye-decolorizing peroxidase

  Catalysis Science & Technology

  D. Linde, M. Cañellas, C. Coscolín, I. Davó-Siguero, A. Romero, F. Lucas, F. J. Ruiz-Dueas, V. Guallar, and A. T. Martínez
• The unravelling of the complex pattern of tyrosinase inhibition

  Scientific Reports

  B. Deri, M. Kanteev, M. Goldfeder, D. Lecina, V. Guallar, N. Adir, and A. Fishman
• Computational Prediction of HIV-1 Resistance to Protease Inhibitors

  Journal of Chemical Information and Modeling

  A. Hosseini, A. Alibés, M. Noguera-Julian, V. Gil, R. Paredes, R. Soliva, M. Orozco, and V. Guallar
• Active-Site-Directed Inhibitors of Prolyl Oligopeptidase Abolish Its Conformational Dynamics

  ChemBioChem

  A. López, F. Herranz-Trillo, M. Kotev, M. Gairí, V. Guallar, P. Bernadó, O. Millet, T. Tarragó, and E. Giralt
• Unveiling the basis of alkaline stability of an evolved versatile peroxidase

  Biochemical Journal

  V.. Saez-Jimenez, S. Acebes, E.. Garcia-Ruiz, A.. Romero, V. Guallar, M.. Alcalde, F.. J. Medrano, A.. T. Martínez, and F.. J. Ruiz-Duenas
• Ecoupling server: A tool to compute and analyze electronic couplings

  Journal of Computational Chemistry

  I. Cabezade Vaca, S. Acebes, and V. Guallar
• Computer-Aided Laccase Engineering: Toward Biological Oxidation of Arylamines

  ACS Catalysis

  G. Santiago, F. de Salas, F. M. Lucas, E. Monza, S. Acebes, A. T. Martínez, S. Camarero, and V. Guallar