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2013
Facilitating the use of large-scale biological data and tools in the era of translational bioinformatics.
Kouskoumvekaki I, Shublaq N, Brunak S
Brief Bioinform. 2013, 2013 |
PubMed
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Discovery of a Novel Selective PPAR Ligand with Partial Agonist Binding Properties by Integrated in Silico in Vitro Work Flow
Kouskoumvekaki I, Petersen RK, Fratev F, Taboureau O, Nielsen TE, Oprea TI, Sonne S, Flindt E, Jónsdóttir SO, Kristiansen K
J. Chem. Inf. Model., DOI: 10.1021/ci3006148, 2013 |
PubMed
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2012
ChemProt-2.0: visual navigation in a disease chemical biology database
Kim Kjærulff S, Wich L, Kringelum J, Jacobsen UP, Kouskoumvekaki I, Audouze K, Lund O, Brunak S, Oprea TI, Taboureau O
Nucleic Acids Res. 2012 Nov 26, 2012 |
PubMed
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The chemical interactome space between the human host and the genetically defined gut metabotypes
Jacobsen UP, Nielsen HB, Hildebrand F, Raes J, Sicheritz-Ponten T, Kouskoumvekaki I, Panagiotou G
The ISME Journal advance online publication, 22 November 2012; doi:10.1038/ismej.2012.141, 2012 |
Relevant URL
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Mapping the Genome of Plasmodium falciparum on the Druglike Chemical Space Reveals Novel Anti-malarial Targets and Potential Drug Leads
Jensen K, Plichta D, Panagiotou G, Kouskoumvekaki I
Mol. BioSyst., 2012 |
DOI: 10.1039/C2MB00008C
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2011
Associating Drugs, Targets and Clinical Outcomes into an Integrated Network Affords a New Platform for Computer- Aided Drug Repurposing
Oprea TI, Nielsen SK, Ursu O, Yang JJ, Taboureau O, Mathias SL, Kouskoumvekaki I, Sklar LA, Bologa C
Molecular Informatics, 2011 |
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Meta-analysis of heterogeneous data sources for genome-scale identification of risk genes in complex phenotypes
Pers TH, Hansen NT, Lage K, Koefoed P, Dworzynski P, Miller ML, Flint TJ, Mellerup E, Dam H, Andreassen OA, Djurovic S, Melle I, Børglum AD, Werge T, Purcell S, Ferreira MA, Kouskoumvekaki I, Workman CT, Hansen T, Mors O, Brunak S
Genet Epidemiol, April 11, 2011 |
PubMed
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Back to the Roots: Prediction of Biologically Active Natural Products from Ayurveda Traditional Medicine
Polur H, Joshi T, Workman CT, Lavekar G, Kouskoumvekaki I
Molecular Informatics, February 10, 2011 |
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2010
Pharmacophore-driven identification of PPARã agonists from natural sources
Petersen RK, Christensen KB, Assimopoulou AN, Fretté X, Papageorgiou VP, Kristiansen K, Kouskoumvekaki I
J Comput Aided Mol Des., November 11, 2010 |
PubMed
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ChemProt: a disease chemical biology database
Taboureau O, Nielsen SK, Audouze K, Weinhold N, Edsgärd D, Roque FS, Kouskoumvekaki I, Bora A, Curpan R, Jensen TS, Brunak S, Oprea TI
Nucleic Acids Research, 2010 |
PubMed
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The interplay of descriptor-based computational analysis with pharmacophore modeling builds the basis for a novel classification scheme for feruloyl esterases
Udatha DB, Kouskoumvekaki I, Olsson L, Panagiotou G
Biotechnology Adv, 2010 |
PubMed
Read abstract
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Navigating the human metabolome for biomarker identification and design of pharmaceutical molecules
Kouskoumvekaki I, Panagiotou G
Journal of Biomedicine and Biotechnology, 2010 |
Read article
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Chemoinformatics-assisted development of new anti-biofilm compounds
Dürig A, Kouskoumvekaki I, Vejborg RM, Klemm P
Appl Microbiol Biotechnol, 2010 |
PubMed
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2008
Prediction of pH-dependent solubility of Histone Deacetylase (HDAC)inhibitors
Kouskoumvekaki I, Hansen NT, Björkling F, Vadlamudi SM, Jónsdóttir SÓ
SAR and QSAR in Environmental Research, 19, 167-177, 2008, 2008 |
PubMed
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Identification of biomarkers for genotyping Aspergilli using non-linear methods for clustering and classification
Kouskoumvekaki I, Yang Z, Jonsdottir SO, Olsson L, Panagiotou G
BMC Bioinformatics,28;9(1):59, 2008 |
PubMed
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2007
Kemoinformatik: Lær computeren at finde nye lægemidler
Kouskoumvekaki I, Hansen NT, Jónsdóttir SÓ
Dansk Kemi, 88(8),23-25, 2007 |
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Monitoring novel metabolic pathways using metabolomics and machine learning: induction of the phosphoketolase pathway in Aspergillus nidulans cultivations
Panagiotou G, Kouskoumvekaki I, Jónsdóttir SÓ, Olsson L
Metabolomics,3,503-516, 2007 |
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2006
Prediction of pH-Dependent Aqueous Solubility of Druglike Molecules
Hansen NT, Kouskoumvekaki I, Jørgensen FS, Brunak S, Jónsdóttir SÓ
Chem. Inf. Model., 46, 2601-9, 2006 |
PubMed
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This file was last modified Friday 31st 2013f May 2013 08:37:15 GMT |
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