Forskningsresultat per år
Forskningsresultat per år
Finland
Forskningsoutput per år
• Postdoctoral researcher, Centre for drug research (CDR), Faculty of pharmacy - Helsinki, Finland
Biocenter Finland network “Drug Discovery and Chemical Biology” (DDCB) Service research in the field of chemoinformatics. QSAR/QSPR predictions of biological proerties of compounds (especially ADME features) and building the database of small synthetic molecules. Grid computing implementation and unix environment administration. Teaching and PhD/Master students supervision.
Previous professional appointments
• Research assistant, LORIA - Nancy, France (2006-2010)
Numeric simulation and knowledge-oriented approach for the discovery of new therapeutic molecules.
• Research engineer, LORIA - Nancy, France (2006)
Virtual Screening Manager for Computational Grids platform development.
• Research assistant, SANOFI – AVENTIS Strasbourg, France (2006)
Exploratory Research (Drug Design). Automation of a protocol for molecular dynamics followed by docking of small molecules and its application on several families of proteins such as the proteases and kinases.
• Research assistant, Louis Pasteur University - Strasbourg, France (2005)
IGBMC ( Institute of Genetics and Molecular and Cell Biology). Implementation of a cascade of extraction of the properties for various proteins families and their ligands, and integration into a database. Construction of 3D proteins structures by homology modeling.
• 3D-QSAR analysis to develop structure-activity hypotheses for designing new drugs.
• Prediction of ligand-receptor binding interactions
• QSAR/QSPR analysis for ADMET property prediction
• Characterization of molecular similarity
• Virtual screening and protein-ligand molecular docking.
• Design and implementation of protein and ligand databases.
• Statistical analysis and knowledge extraction in proteins and ligands databases.
• Grid computing implementation and Unix environment administration (clusters, servers, workstations).
Major teaching duties
• Faculty of pharmacy - Helsinki, Finland
Teaching in Fundamentals of molecular modeling course (Code: 590287)
• Faculty of pharmacy - Helsinki, Finland
Introduction to Chemoinformatics and QSAR/QSPR modeling (Code: 590334)
Scientific awards and honours
• Chancellor's Travel Grant (University of Helsinki) for IT Infrastructure & Cloud Computing, Singapore (May 28-31, 2013)
• Competitive postdoctoral position at CDR (2010)
• Bill & Melinda Gates Foundation Grand Challenges Explorations Grant (2009)
• National Center for Scientific Research (CNRS ) PhD Grants (2007, 2008)
Other scientific or academic merits and activities
• Peer review for the journal PLoS ONE
• Peer review for Bentham Science Publishers
• Peer review for Journal of Molecular Modeling
• Peer review for Bentham Science Publishers
Forskningsoutput: Tidskriftsbidrag › Artikel › Vetenskaplig › Peer review
Forskningsoutput: Tidskriftsbidrag › Artikel › Vetenskaplig › Peer review
Forskningsoutput: Tidskriftsbidrag › Artikel › Vetenskaplig › Peer review
Forskningsoutput: Tidskriftsbidrag › Artikel › Vetenskaplig › Peer review
Forskningsoutput: Tidskriftsbidrag › Artikel › Vetenskaplig › Peer review
Tanoli, Z. (Projektledare), Ghemtio, L. (deltagare), Kushnir, A. (deltagare), Schulman, A. (deltagare), Srivastava, A. (deltagare), Tripathi, G. (deltagare) & Özcan, U. O. (deltagare)
SUOMEN AKATEMIA Vähäkylä Leena
01/09/2022 → 31/08/2026
Projekt: Finlands Akademi: Akademiprojektsbidrag
Urtti, A. (Projektledare), Ghemtio, L. (Deltagare) & Hagström, M. (Projektledare)
01/01/2014 → 31/12/2016
Projekt: Forskningsprojekt
Ghemtio, L. (Skapad av), Journal of cheminformatics, 2017
DOI: 10.1186/s13321-016-0141-7, http://idaapm.helsinki.fi
Datauppsättning
Borrel, A. (Talare: Presentation), Zhang, Y. (New classification), Ghemtio Wafo, L. A. (New classification), Regad, L. (New classification), Boije af Gennäs, P. G. (New classification), Camproux, A.-C. (New classification), Yli-Kauhaluoma, J. T. (Närvarande) & Xhaard, H. G. M. (New classification)
Aktivitet: Typer för deltagande i eller organisering av evenemang › Arrangemang av och deltagande i konferens/workshop/kurs/seminarium