Results 81 - 90 of about 99
Original articles in indexed journals - Structural Bioinformatics - Systems Pharmacology
van Mulligen EM, Cases M, Hettne K, Molero E, Weeber M, Robertson KA, Oliva B, de la Calle G, Maojo V. Training Multidisciplinary Biomedical Informatics Students: Three Years of Experience. J Am Med Inf Assoc 2008;15(2):246-254. PMID: 18096914 . DOI: 10.1197/jamia.M2488.
2008
Original articles in indexed journals - Systems Pharmacology
Hettne K, Cases M, Boyer S, Mestres J. Connecting Small Molecules to Nuclear Receptor Pathways. Curr Top Med Chem 2007; 7:1530-6. PMID: 17897040 .
2007
Original articles in indexed journals - Systems Pharmacology
Ekins S, Mestres J, Testa B. In Silico Pharmacology for Drug Discovery: Methods for Virtual Ligand Screening and Profiling. Br J Pharmacol 2007;152:9-20. PMID: 17549047 . DOI: 10.1038/sj.bjp.0707305.
2007
Original articles in indexed journals - Systems Pharmacology
Hettne K, de Mos M, de Bruijn AGJ, Weeber M, Boyer S, van Mulligen EM, Cases M, Mestres J, van der Lei J. Applied information retrieval and multidisciplinary research: new mechanistic hypotheses in complex regional pain syndrome. J Biomed Discov Collab 2007; 2:2.. PMID: 17480215 .
2007
Original articles in indexed journals - Systems Pharmacology
García-Serna R, Opatowski L, Mestres J. FCP: Functional Coverage of the Proteome by Structures. Bioinformatics 2006; 22: 1792-3. PMID: 16705012 . DOI: 10.1093/bioinformatics/btl188.
2006
Original articles in indexed journals - Systems Pharmacology
Mestres J, Martín-Couce L, Gregori-Puigjané E, Cases M, Boyer S. A Ligand-based Approach to In Silico Pharmacology: Nuclear Receptor Profiling. J Chem Inf Model 2006; 46: 2725-36. PMID: 17125212 . DOI: 10.1021/ci600300k.
2006
Original articles in indexed journals - Systems Pharmacology
Gregori-Puigjané E, Mestres J. SHED: Shannon Entropy Descriptors from Topological Feature Distributions. J Chem Inf Model 2006; 46: 1615-22. PMID: 16859293 . DOI: 10.1021/ci0600509.
2006
Original articles in indexed journals - Systems Pharmacology
Mestres J. Putting Molecular Similarity into Context: Asymmetric Indices for Field-based Similarity Measures. J Math Chem 2006; 39 (1): 107-18 DOI: 10.1007/s10910-005-9007-3.
2006
Original articles in indexed journals - Systems Pharmacology
Mestres, J. Representativity of target families in the Protein Data Bank: impact for family-directed structure-based drug discovery. Drug Discov Today 2005; 10 (23/24): 1629-37.. PMID: 16376823 . DOI: 10.1016/S1359-6446(05)03593-2.
2005
Original articles in indexed journals - Systems Pharmacology
Cooper A, Nutley M, MacLean E, Cameron K, Fielding L, Mestres J, Palin R. Mutual Induced Fit in Cyclodextrin-Rocuronium Complexes. Org Biomol Chem 2005; 3: 1863-71.. PMID: 15889169 . DOI: 10.1039/b415903a.
2005