Laboratory of Computational Medicine

Select a year : 2024 – 2023 – 2022 – 2021 – 2020 – 2019 – 2018 – 2017 – 2016 – 2015 – 2014 – 2013 – 2012 – 2011 – 2010 – 2009 – 2008 – 2007 – 2006 – 2005 – 2004 – 2003 – 2002 – 2001 – 2000 – 1999 – 1998 – 1997 – All Years

2001

1. Nebot-Cegarra, J. Fabregas, PJ. Campillo, M. Ricart, S.
   “Separation between the digestive and the respiratory lumina during the human embryonic period: morphometric study along the tracheo-oesophageal septum.”
   J Anat 198(0) 117–24
   


2. Lopez-Rodriguez, ML. Murcia, M. Benhamu, B. Olivella, M. Campillo, M. Pardo, L.
   “Computational model of the complex between GR113808 and the 5-HT4 receptor guided by site-directed mutagenesis and the crystal structure of rhodopsin.”
   J Comput Aided Mol Des 15(11) 1025–33
   


3. Govaerts, C. Blanpain, C. Deupi, X. Ballet, S. Ballesteros, JA. Wodak, SJ. Vassart, G. Pardo, L. Parmentier, M.
   “The TXP motif in the second transmembrane helix of CCR5. A structural determinant of chemokine-induced activation.”
   J Biol Chem 276(16) 13217–25
   


4. Lopez-Rodriguez, ML. Murcia, M. Benhamu, B. Viso, A. Campillo, M. Pardo, L.
   “3-D-QSAR/CoMFA and recognition models of benzimidazole derivatives at the 5-HT(4) receptor.”
   Bioorg Med Chem Lett 11(21) 2807–11
   


5. Lopez-Rodriguez, M.L. Benhamu, B. Viso, A. Murcia, M. Pardo, L.
   “Study of the bioactive conformation of novel 5-HT4 receptor ligands: influence of an intramolecular hydrogen bond”
   Tetrahedron 57(31) 6745–6749
   


6. Govaerts, C. Lefort, A. Costagliola, S. Wodak, SJ. Ballesteros, JA. Van, Sande, J. Pardo, L. Vassart, G.
   “A conserved Asn in transmembrane helix 7 is an on/off switch in the activation of the thyrotropin receptor.”
   J Biol Chem 276(25) 22991–9
   


7. Lopez-Rodriguez, ML. Morcillo, MJ. Fernandez, E. Rosado, ML. Pardo, L. Schaper, K.
   “Synthesis and structure-activity relationships of a new model of arylpiperazines. Study of the 5-HT(1a)/alpha(1)-adrenergic receptor affinity by classical hansch analysis, artificial neural networks, and computational simulation of ligand recognition.”
   J Med Chem 44(2) 198–207
   


8. Bosch, D. Foloppe, N. Pastor, N. Pardo, L. Campillo, M.
   “Calibrating nucleic acids torsional energetics in force-field: insights from model compounds”
   J Mol Struct (THEOCHEM) 537(0) 283–305