Irene Kouskoumvekaki
- 2013
- Published
ChemProt-2.0: visual navigation in a disease chemical biology database. / Kjærulff, Sonny Kim; Wich, Louis; Kringelum, Jens Vindahl; Jacobsen, Ulrik Plesner; Kouskoumvekaki, Irene; Audouze, Karine Marie Laure; Lund, Ole; Brunak, Søren; Oprea, Tudor; Taboureau, Olivier .
In: Nucleic Acids Research, Vol. 41, No. D1, 2013, p. D464-D469.Publication: Research - peer-review › Journal article – Annual report year: 2013
- Published
Discovery of a novel selective PPARγ ligand with partial agonist binding properties by integrated in silico / in vitro work flow. / Kouskoumvekaki, Irene; Petersen, Rasmus K.; Fratev, Filip Filipov ; Taboureau, Olivier ; Nielsen, Thomas Eiland; Oprea, Tudor; Sonne, Si Brask; Flindt, Esben N.; Jonsdottir, Svava Osk; Kristiansen, Karsten.
In: Journal of Chemical Information and Modeling, Vol. 53, No. 4, 2013, p. 923-937.Publication: Research - peer-review › Journal article – Annual report year: 2013
- Published
The chemical interactome space between the human host and the genetically defined gut metabotypes. / Jacobsen, Ulrik Plesner; Nielsen, Henrik Bjørn; Hildebrand, Falk; Raes, Jeroen; Sicheritz-Pontén, Thomas; Kouskoumvekaki, Irene; Panagiotou, Gianni.
In: I S M E Journal, Vol. 7, 2013, p. 730-742.Publication: Research - peer-review › Journal article – Annual report year: 2012
- 2012
- Published
Mapping the genome of Plasmodium falciparum on the drug-like chemical space reveals novel anti-malarial targets and potential drug leads. / Jensen, Kasper; Plichta, Damian Rafal; Panagiotou, Gianni; Kouskoumvekaki, Irene.
In: Molecular BioSystems, Vol. 8, No. 6, 2012, p. 1678-1685.Publication: Research - peer-review › Journal article – Annual report year: 2012
- 2011
- Published
Associating Drugs, Targets and Clinical Outcomes into an Integrated Network Affords a New Platform for Computer-Aided Drug Repurposing. / Oprea, Tudor; Nielsen, Sonny Kim; Ursu, Oleg; Yang, Jeremy J.; Taboureau, Olivier; Mathias, Stephen L.; Kouskoumvekaki, Irene; Sklar, Larry A.; Bologa, Cristian G.
In: Molecular Informatics, Vol. 30, No. 2-3, 2011, p. 100-111.Publication: Research - peer-review › Conference article – Annual report year: 2011
- Published
Back to the Roots: Prediction of Biologically Active Natural Products from Ayurveda Traditional Medicine. / Polur, Honey; Joshi, Tejal; Workman, Christopher; Lavekar, Gandhidas; Kouskoumvekaki, Irene.
In: Molecular Informatics, Vol. 30, No. 2-3, 2011, p. 181-187.Publication: Research - peer-review › Conference article – Annual report year: 2011
- Published
ChemProt: a disease chemical biology database. / Taboureau, Olivier; Nielsen, Sonny Kim; Audouze, Karine Marie Laure; Weinhold, Nils; Edsgard, Stefan Daniel; Roque, francisco jose sousa simôes almeida; Kouskoumvekaki, Irene; Bora, A.; Curpan, R.; Jensen, Thomas Skøt; Brunak, Søren; Oprea, Tudor.
In: Nucleic Acids Research, Vol. 39, No. Issue Suppl. 1, 2011, p. D367-372.Publication: Research - peer-review › Journal article – Annual report year: 2010
- Published
Meta-Analysis of Heterogeneous Data Sources for Genome-Scale Identification of Risk Genes in Complex Phenotypes. / Pers, Tune Hannes; Hansen, Niclas Tue; Hansen, Kasper Lage; Koefoed, Pernille; Dworzynski, Piotr; Miller, Martin Lee; Flint, Tracey J.; Mellerup, Erling; Dam, Henrik; Andreassen, Ole A.; Djurovic, Srdjan; Melle, Ingrid; Børglum, Anders D.; Werge, Thomas; Purcell, Shaun; Ferreira, Manuel A.; Kouskoumvekaki, Irene; Workman, Christopher; Hansen, Torben; Mors, Ole; Brunak, Søren.
In: Genetic Epidemiology, Vol. 35, No. 5, 2011, p. 318-332.Publication: Research - peer-review › Journal article – Annual report year: 2011
- Published
Pharmacophore-driven identification of PPARγ agonists from natural sources. / Petersen, R. K.; Christensen, Kathrine Bisgaard; Assimopoulou, A. N.; Fretté, X.; Papageorgiou, V. P.; Kristiansen, K.; Kouskoumvekaki, Irene.
In: Journal of Computer - Aided Molecular Design, Vol. 25, No. 2, 2011, p. 107-116.Publication: Research - peer-review › Journal article – Annual report year: 2010
- Published
The interplay of descriptor-based computational analysis with pharmacophore modeling builds the basis for a novel classification scheme for feruloyl esterases. / Udatha, D.B.R.K. Gupta; Kouskoumvekaki, Irene; Olsson, Lisbeth; Panagiotou, Gianni.
In: Biotechnology Advances, Vol. 29, No. 1, 2011, p. 94-110.Publication: Research - peer-review › Journal article – Annual report year: 2010