| 3D-QSAR methods on the basis of ligand–receptor complexes. Application of COMBINE and GRID/GOLPE methodologies to a series of CYP1A2 ligands JJ Lozano, M Pastor, G Cruciani, K Gaedt, NB Centeno, F Gago, F Sanz Journal of Computer-Aided Molecular Design 14, 341-353, 2000 | 101 | 2000 |
| New Serotonin 5-HT2A, 5-HT2B, and 5-HT2C Receptor Antagonists: Synthesis, Pharmacology, 3D-QSAR, and Molecular Modeling of (Aminoalkyl)benzo and … J Brea, J Rodrigo, A Carrieri, F Sanz, MI Cadavid, MJ Enguix, M Villazón, ... Journal of Medicinal Chemistry 45 (1), 54-71, 2002 | 81 | 2002 |
| Iodine atoms: a new molecular feature for the design of potent transthyretin fibrillogenesis inhibitors T Mairal, J Nieto, M Pinto, MR Almeida, L Gales, A Ballesteros, ... PLoS One 4 (1), e4124, 2009 | 65 | 2009 |
| Three-dimensional modelling of human cytochrome P450 1A2 and its interaction with caffeine and MeIQ JJ Lozano, E López-de-Briñas, NB Centeno, R Guigó, F Sanz Journal of computer-aided molecular design 11, 395-408, 1997 | 65 | 1997 |
| Design, Synthesis, and Structure−Activity Relationships of 1-,3-,8-, and 9-Substituted-9-deazaxanthines at the Human A2B Adenosine Receptor A Carotti, MI Cadavid, NB Centeno, C Esteve, MI Loza, A Martinez, ... Journal of medicinal chemistry 49 (1), 282-299, 2006 | 47 | 2006 |
| Neuronal nicotinic receptor agonists: a multi-approach development of the pharmacophore O Nicolotti, M Pellegrini-Calace, A Carrieri, C Altomare, NB Centeno, ... Journal of computer-aided molecular design 15, 859-872, 2001 | 47 | 2001 |
| 1-, 3-and 8-substituted-9-deazaxanthines as potent and selective antagonists at the human A2B adenosine receptor A Stefanachi, JM Brea, MI Cadavid, NB Centeno, C Esteve, MI Loza, ... Bioorganic & medicinal chemistry 16 (6), 2852-2869, 2008 | 41 | 2008 |
| 8-Substituted-9-deazaxanthines as adenosine receptor ligands: design, synthesis and structure-affinity relationships at A2B A Carotti, A Stefanachi, E Raviña, E Sotelo, MI Loza, MI Cadavid, ... European journal of medicinal chemistry 39 (10), 879-887, 2004 | 41 | 2004 |
| Novel approaches for modeling of the A1 adenosine receptor and its agonist binding site H Gutiérrez‐de‐Terán, NB Centeno, M Pastor, F Sanz Proteins: Structure, Function, and Bioinformatics 54 (4), 705-715, 2004 | 37 | 2004 |
| Pyridazine derivatives. Part 27: A joint theoretical and experimental approach to the synthesis of 6-phenyl-4, 5-disubstituted-3 (2H)-pyridazinones E Sotelo, NB Centeno, J Rodrigo, E Raviña Tetrahedron 58 (12), 2389-2395, 2002 | 32 | 2002 |
| Comparative modelling of protein structure and its impact on microbial cell factories NB Centeno, J Planas-Iglesias, B Oliva Microbial Cell Factories 4 (1), 20, 2005 | 30 | 2005 |
| Computational study of the conformational domains of peptide T M Filizola, NB Centeno, JJ Perez Journal of Peptide Science: An Official Publication of the European Peptide …, 1997 | 29 | 1997 |
| Teaching structural bioinformatics at the undergraduate level NB Centeno, J Villà‐Freixa, B Oliva Biochemistry and molecular biology education 31 (6), 386-391, 2003 | 28 | 2003 |
| Modulation of the fibrillogenesis inhibition properties of two transthyretin ligands by halogenation EY Cotrina, M Pinto, L Bosch, M Vilà, D Blasi, J Quintana, NB Centeno, ... Journal of Medicinal Chemistry 56 (22), 9110-9121, 2013 | 27 | 2013 |
| Theoretical evidence of a salt bridge disruption as the initiating process for the α1d‐adrenergic receptor activation: A molecular dynamics and docking study A Carrieri, NB Centeno, J Rodrigo, F Sanz, A Carotti Proteins: Structure, Function, and Bioinformatics 43 (4), 382-394, 2001 | 22 | 2001 |
| Structure–Activity Relationship Study of Opiorphin, a Human Dual Ectopeptidase Inhibitor with Antinociceptive Properties M Rosa, G Arsequell, C Rougeot, LP Calle, F Marcelo, M Pinto, ... Journal of medicinal chemistry 55 (3), 1181-1188, 2012 | 20 | 2012 |
| Comparative Analysis of Putative Agonist‐Binding Modes in the Human A1 Adenosine Receptor H Gutiérrez‐de‐Terán, M Pastor, NB Centeno, J Åqvist, F Sanz ChemBioChem 5 (6), 841-849, 2004 | 18 | 2004 |
| Docking of a human rhinovirus neutralizing antibody onto the viral capsid J Tormo, NB Centeno, E Fontana, T Bubendorfer, I Fita, D Blaas Proteins: Structure, Function, and Bioinformatics 23 (4), 491-501, 1995 | 18 | 1995 |
| Efecto del sexo en el rendimiento académico de estudiantes de biología biosanitaria de la Universitat Pompeu Fabra NB Centeno, G Rodríguez, E Moyano, M Girvent, J Pérez FEM: Revista de la Fundación Educación Médica 22 (6), 269-272, 2019 | 15 | 2019 |
| Comparison of biomolecules on the basis of Molecular Interaction Potentials J Rodrigo, M Barbany, H Gutiérrez-de-Terán, NB Centeno, M de-Càceres, ... Journal of the Brazilian Chemical Society 13, 795-799, 2002 | 14 | 2002 |
