Tools
Results 81 - 90 of about 114
Original articles in indexed journals - Integrative Biomedical Informatics - PharmacoInformatics
Dezi C, Brea J, Alvarado M, Raviña E, Masaguer CF, Loza MI, Sanz F, Pastor M. Multistructure 3D-QSAR studies on a series of conformationally constrained butyrophenones docked into a new homology model of the 5-HT2A receptor. J Med Chem 2007; 50(14): 3242-55.. PMID: 17579386 .
2007
Original articles in indexed journals - PharmacoInformatics
Ahlström MM, Ridderström M, Zamora I, Luthman K. CYP2C9 Structure-Metabolism Relationships: Optimizing the Metabolic Stability of COX-2 Inhibitors. J Med Chem 2007; 50: 4444-52. PMID: 17696334 . DOI: 10.1021/jm0705096.
2007
Original articles in indexed journals - Integrative Biomedical Informatics - PharmacoInformatics
Brea J, Castro M, Loza MI, Masaguer CF, Raviña E, Dezi C, Pastor M, Sanz F, Cabrero A, Galán-Rodríguez B, Fernández-Espejo E, Maldonado R and Robledo P. QF2004B, A potential antipsychotic butyrophenone derivative with similar pharmacological properties to clozapine. Neuropharmacology 2006; 51(2):251-62. PMID: 16697427 .
2006
Original articles in indexed journals - PharmacoInformatics
Zhou D, Afzelius L, Grimm SW, Andersson TB, Zauhar RJ, Zamora I. Comparison of methods for the prediction of the metabolic sites for CYP3A4-mediated metabolic reactions. Drug Metab Dispos 2006; 34(6):976-83. PMID: 16540587 . DOI: 10.1124/dmd.105.008631.
2006
Original articles in indexed journals - PharmacoInformatics
Neuhoff S, Artursson P, Zamora I, Ungell AL. Impact of Extracellular Protein Binding on Passive and Active Drug Transport Across Caco-2 Cells. Pharm Res 2006; 23(2): p.350-9.. PMID: 16388407 . DOI: 10.1007/s11095-005-9304-3.
2006
Original articles in indexed journals - Integrative Biomedical Informatics - PharmacoInformatics
Carotti A, Cadavid MI, Centeno NB, Esteve C, Loza MI, Martinez A, Nieto R, Ravina E, Sanz F, Segarra V, Sotelo E, Stefanachi A, Vidal B. Design, synthesis, and structure-activity relationships of 1-,3-,8-, and 9-substituted-9-deazaxanthines at the human A2B adenosine receptor. J Med Chem 2006; 49(1): 282-99.. PMID: 16392813 .
2006
Original articles in indexed journals - Integrative Biomedical Informatics - PharmacoInformatics
Fontaine F, Pastor M, Zamora I, Sanz F. Anchor-GRIND: Filling the Gap between Standard 3D QSAR and the GRid-INdependent Descriptors. J Med Chem 2005; 48: 2687-94.. PMID: 15801859 .
2005
Original articles in indexed journals - Integrative Biomedical Informatics - PharmacoInformatics
Gutiérrez-de-Terán H, Centeno NB, Pastor M, Sanz F. Novel approaches for modeling of the A1 adenosine receptor and its agonist binding site. Proteins 2004; 54: 705-15.
2004
Original articles in indexed journals - Integrative Biomedical Informatics - PharmacoInformatics
Gutiérrez-de-Terán H, Pastor M, Centeno NB, Aqvist J, Sanz F. Comparative analysis of putative agonist binding modes in the human A1 adenosine receptor. ChemBioChem 2004; 5: 841-9.
2004
Original articles in indexed journals - Integrative Biomedical Informatics - PharmacoInformatics
Fontaine F, Pastor M, Gutiérrez-de-Terán H, Lozano JJ, Sanz F. Use of alignment-free molecular descriptors in diversity analysis and optimal sampling of molecular libraries. Mol Divers 2003; 6: 135-47.
2003
