Jose Luis Dominguez

University of Santiago de Compostela, Santiago de Compostela, Galicia, Spain

grad student

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Domínguez JL, Fernández-Nieto F, Castro M, et al. (2015) Computer-aided structure-based design of multitarget leads for Alzheimer's disease. Journal of Chemical Information and Modeling. 55: 135-48
Domínguez JL, Villaverde MC, Sussman F. (2013) Effect of pH and ligand charge state on BACE-1 fragment docking performance. Journal of Computer-Aided Molecular Design. 27: 403-17
Sussman F, Villaverde MC, Domínguez JL, et al. (2013) On the active site protonation state in aspartic proteases: implications for drug design. Current Pharmaceutical Design. 19: 4257-75
Domínguez JL, Gossas T, Carmen Villaverde M, et al. (2012) Experimental and 'in silico' analysis of the effect of pH on HIV-1 protease inhibitor affinity: implications for the charge state of the protein ionogenic groups. Bioorganic & Medicinal Chemistry. 20: 4838-47
Sussman F, Otero JM, Villaverde MC, et al. (2011) On a possible neutral charge state for the catalytic dyad in β-secretase when bound to hydroxyethylene transition state analogue inhibitors. Journal of Medicinal Chemistry. 54: 3081-5