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Original articles in indexed journals - PharmacoInformatics - GPCR Drug Discovery

Kaczor AA, Guixà-González R, Carrió P, Obiol-Pardo C, Pastor M, Selent J. Fractal dimension as a measure of surface roughness of G protein-coupled receptors: implications for structure and function. J Mol Model, 2012; 18 (9):4465-4475 . PMID: 22643967 . DOI: 10.1007/s00894-012-1431-2.

2012

Other - Integrative Biomedical Informatics - PharmacoInformatics

Massaguer OL, Sanz F, Pastor M. Use of advanced knowledge management tools for maintaining an updated repository of toxicologically relevant information (Poster). International Symposium on Medicinal Chemistry, Berlin, Germany. 2-6 September 2012

2012

Other - Integrative Biomedical Informatics - PharmacoInformatics

Carrió P, Sanz F, Pastor M. Searching for homogeneity rafts in a chemical sea. A better platform for building QSAR models on top? (Poster) EuroQSAR 2012, Vienna, Austria, 26-30 August 2012

2012

Other - Integrative Biomedical Informatics - PharmacoInformatics

Carrio P, Cases M, Wichard JW, Sanz F, Pastor M. . Exploring the applicability of structural masking strategies in the eTOX project (Poster). EuroQSAR 2012, Vienna, Austria, 26-30 August 2012

2012

Original articles in indexed journals - PharmacoInformatics - Computational Biophysics - GPCR Drug Discovery

Bruno A, Costantino G, de Fabritiis G, Pastor M, Selent J. Membrane-Sensitive Conformational States of Helix 8 in the Metabotropic Glu2 Receptor, a Class C GPCR. PLoS One. 2012;7(8):e42023 . PMID: 22870276 . DOI: 10.1371/journal.pone.0042023.

2012

Original articles in indexed journals - PharmacoInformatics - GPCR Drug Discovery

Fernandez-Mariño AI, Porras-González C, Gonzalez-Rodriguez P, Selent J, Pastor M, Ureña J, Castellano A, Valverde MA, Fernández-Fernández JM. Tungstate activates BK channels in a β subunit- and Mg2+-dependent manner: relevance for arterial vasodilatation. Cardiovasc Res. 2012. . PMID: 22473360 . DOI: 10.1093/cvr/cvs139.

2012

Original articles in indexed journals - Integrative Biomedical Informatics - PharmacoInformatics

Briggs K, Cases M, Heard DJ, Pastor M, Pognan F, Sanz F, Schwab CH, Steger-Hartmann T, Sutter A, Watson DK, Wichard JD. Inroads to Predict in Vivo Toxicology—An Introduction to the eTOX Project. Int J Mol Sci, 2012; 13(3), 3820-3846.. PMID: 22489185 . DOI: 10.3390/ijms13033820.

2012

Original articles in indexed journals - PharmacoInformatics

Rosa M, Arsequell G, Rougeot C, Calle LP, Marcelo F, Pinto M, Centeno NB, Jiménez-Barbero J, Valencia G. Structure-Activity Relationship Study of Opiorphin, a Human Dual Ectopeptidase Inhibitor with Antinociceptive Properties. J Med Chem, 2012;55(3):1181-8. PMID: 22224710 . DOI: 10.1021/jm2012112.

2012

Original articles in indexed journals - PharmacoInformatics

Pinto M, Rougeot C, Gracia L et al (including Centeno NB). Proposed Bioactive Conformations of Opiorphin, an Endogenous Dual APN/NEP Inhibitor. ACS MEDICINAL CHEMISTRY LETTERS, 2012; 3; 1: 20-24 DOI: 10.1021/ml200182v.

2012

Original articles in indexed journals - PharmacoInformatics - GPCR Drug Discovery

Jung C, Gené GG, Tomás M, Plata C, Selent J, Pastor M, Fandos C, Senti M, Lucas G, Elosua R, Valverde MA. A gain-of-function SNP in TRPC4 cation channel protects against myocardial infarction. Cardiovasc Res, 2011; 91(3): 465-71 . PMID: 21427121 . DOI: 10.1093/cvr/cvr083.

2011



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