Domaines de compétences
- Services d'information bibliothécaire - Gestion des données de recherche scientifique - Administration système (Unix, Mac OSX et MS Windows) - Modélisation moléculaire, en particulier simulations de dynamique moléculaire classique et théorie de la fonctionnelle de densité appliquées aux complexes de métaux de transition - Résonance paramagnétique électronique - Programmation (Python, Javascript, C, Fortran, Unix shell, Matlab)
Publications
Publications Infoscience
Publications
2024 The Zenodo communities: visibility and FAIRness of your dataset. Example at the EPFL A. Borel
Love Data Week 2024 , [online] , 14.02.2024 . 2023 A research data files & folders naming convention for the impatient A. Borel
2023 2022 README file for datasets - Best practices and template F. Varrato ; A. Borel ; C. Gabella
2022-11-23 2020 EPFL Library Publishing Support Fastguides B. Marselli ; A. Hunziker ; M. Platon ; M. Velasco ; A. Borel
et al.
Open Access Week 2020 , Lausanne, Switzerland , 19-26.10.2019 . 2019 RDM Walkthrough Guide F. Varrato ; A. Borel
2019 2013 Infoscience, EPFL's institutional repository: facts and prospects P. Devaud ; A. Borel
Open Access: Authors, publishers, investors and institutions for the dissemination of the scientific research's results , Lausanne , October 24, 2013 . ChemCalc: a building block for tomorrow’s chemical infrastructure L. Patiny ; A. Borel
Journal of Chemical Information and Modeling . 2013 . Vol. 53 , num. 5 , p. 1223-1228. DOI : 10.1021/ci300563h. 2012 DRM et bibliothèques A. Borel
Flash informatique . 2012 . num. spécial été , p. 13-14. Computer-aided Universal Decimal Classification A. Borel
European Library Automation Group Conference 2012 , Palma de Mallorca, Spain , May 14-18, 2012 . Electronic fine structure calculation of [Gd(DOTA)(H2O)]- using LF-DFT: The zero field splitting F. Senn ; L. Helm ; A. Borel ; C. A. Daul
Comptes Rendus Chimie . 2012 . Vol. 15 , num. 2-3 , p. 250-254. DOI : 10.1016/j.crci.2011.10.008. 2011 Be realistic, demand the impossible: Comparison of 4 discovery tools using real data at the EPFL Library D. Aymonin ; A. Borel ; R. Grolimund ; T. Guignard ; G. Iffland
et al.
2011 MarcXimiL : near duplicates detection (and similarity analysis) J. Krause ; A. Borel
CERN Workshop on Innovations in Scholarly Communication (OAI7) , Geneva , June 22-24, 2011 . MarcXimiL - A deduplication tool for library records... and more A. Borel
European Library Automation Group Conference 2011 , Prague, Czech Republic , May 24-27, 2011 . 2009 Multiple Frequency and Variable Temperature EPR study of Gd(III) polyaminocarboxylates: analysis and comparison of the magnetically dilute powder and the frozen solution spectra M. Benmelouka ; J. Van Tol ; A. Borel ; S. Nellutla ; M. Port
et al.
Helvetica Chimica Acta . 2009 . Vol. 92 , p. 2173-2185. DOI : 10.1002/hlca.200900117. Development of a flexible tool for the automatic comparison of bibliographic records. Application to sample collections - Développement d'un logiciel flexible pour la comparaison de notices bibliographiques et application à différentes collections A. Borel ; J. Krause
2009 A ruthenium-based metallostar: synthesis, sensitized luminescence and 1H relaxivity L. Moriggi ; A. Aebischer ; C. Cannizzo ; A. Sour ; A. Borel
et al.
Dalton Transactions . 2009 . num. 12 , p. 2088-2095. DOI : 10.1039/b818599a. Site Selective Functionalization of Fluorinated Nitrogen Heterocycles M. Schlosser ; A. Borel ; L. Patiny
Fluorinated Heterocycles ; Washington, DC : American Chemical Society , 2009. p. 23-37. 2008 Towards the Rational Design of MRI Contrast Agents: Electron Spin Relaxation Is Largely Unaffected by the Coordination Geometry of Gadolinium(III)-DOTA-Type Complexes A. Borel ; J. F. Bean ; R. B. Clarkson ; L. Helm ; L. Moriggi
et al.
Chemistry - A European Journal . 2008 . Vol. 14 , num. 9 , p. 2658-2667. DOI : 10.1002/chem.200701747. 2007 Multiple-frequency EPR spectra of two aqueous Gd3+ polyaminopolypyridinecarboxylate complexes: a study of high field effects A. Borel ; S. Laus ; A. Ozarowski ; C. Gateau ; A. Nonat
et al.
Journal of Physical Chemistry A . 2007 . Vol. 111 , num. 25 , p. 5399-5407. DOI : 10.1021/jp066921z. Stochastic Liouville equation treatment of the electron paramagnetic resonance line shape of an S-state ion in solution A. Borel ; R. B. Clarkson ; R. L. Belford
Journal of Chemical Physics . 2007 . Vol. 126 , num. 5 , p. 054510/1-054510/11. DOI : 10.1063/1.2433947. Design of Gd(III)-Based Magnetic Resonance Imaging Contrast Agents: Static and Transient Zero-Field Splitting Contributions to the Electronic Relaxation and Their Impact on Relaxivity M. Benmelouka ; A. Borel ; L. Moriggi ; L. Helm ; A. E. Merbach
Journal of Physical Chemistry B . 2007 . Vol. 111 , num. 4 , p. 832-840. DOI : 10.1021/jp0633289. 2006 Variable Temperature and EPR Frequency Study of Two Aqueous Gd(III) Complexes with Unprecedented Sharp Lines A. Borel ; H. Kang ; C. Gateau ; M. Mazzanti ; R. B. Clarkson
et al.
Journal of Physical Chemistry A . 2006 . Vol. 110 , num. 45 , p. 12434-12438. DOI : 10.1021/jp065445+. A High-Frequency EPR Study of Frozen Solutions of Gd(III) Complexes: Straightforward Determination of the Zero-Field Splitting Parameters and Simulation of the NMRD Profiles M. Benmelouka ; J. Van Tol ; A. Borel ; M. Port ; L. Helm
et al.
Journal of the American Chemical Society . 2006 . Vol. 128 , num. 24 , p. 7807-7816. DOI : 10.1021/ja0583261. A Starburst-Shaped Heterometallic Compound Incorporating Six Densely Packed Gd3+ Ions J. B. Livramento ; A. Sour ; A. Borel ; A. E. Merbach ; É. Tóth
Chemistry - A European Journal . 2006 . Vol. 12 , num. 4 , p. 989-1003. DOI : 10.1002/chem.200500969. A Theoretical Characterization of Covalency in Rare Earth Complexes through Their Absorption Electronic Properties: f-f Transitions L. Petit ; A. Borel ; C. Daul ; P. Maldivi ; C. Adamo
Inorganic Chemistry . 2006 . Vol. 45 , num. 18 , p. 7382-7388. DOI : 10.1021/ic060149x. Multiplets of free d- and f-metal ions: A systematic DFT study A. Borel ; C. A. Daul
Journal of Molecular Structure: THEOCHEM . 2006 . Vol. 762 , num. 1-3 , p. 93-107. DOI : 10.1016/j.theochem.2005.09.023. 2005 The effect of pyridinecarboxylate chelating groups on the stability and electronic relaxation of gadolinium complexes N. Chatterton ; C. Gateau ; M. Mazzanti ; J. Pécaut ; A. Borel
et al.
Dalton Transactions . 2005 . Vol. 6 , p. 1129-1135. DOI : 10.1039/b416150e. High Relaxivity Confined to a Small Molecular Space: A Metallostar-Based, Potential MRI Contrast Agent J. B. Livramento ; É. Tóth ; A. Sour ; A. Borel ; A. E. Merbach
et al.
Angewandte Chemie, International Edition . 2005 . Vol. 44 , num. 10 , p. 1480-1484. DOI : 10.1002/anie.200461875. Water-Soluble Gadofullerenes: Toward High-Relaxivity, pH-Responsive MRI Contrast Agents É. Tóth ; R. D. Bolskar ; A. Borel ; G. González ; L. Helm
et al.
Journal of the American Chemical Society . 2005 . Vol. 127 , num. 2 , p. 799-805. DOI : 10.1021/ja044688h. 2004 Hybrid ligand-field theory/quantum chemical calculation of the fine structure and ZFS in lanthanide(III) complexes A. Borel ; L. Helm ; C. A. E. Daul
Chemical Physics Letters . 2004 . Vol. 383 , num. 5,6 , p. 584-591. DOI : 10.1016/j.cplett.2003.11.082. Molecular dynamics simulations of the internal mobility of Gd3+-based MRI contrast agents: consequences for water proton relaxivity A. Borel ; F. Yerly ; L. Helm ; A. E. Merbach
Chimia . 2004 . Vol. 58 , num. 4 , p. 200-203. DOI : 10.2533/000942904777678055. Molecular dynamics of Gd(III) complexes in aqueous solution by HF EPR A. Borel ; L. Helm ; A. E. Merbach
Very High Frequency (VHF) ESR/EPR ; New York : Plenum Press , 2004. p. 207-247. 2003 MD simulations of acyclic and macrocyclic Gd3+-based MRI contrast agents: Influence of the internal mobility on water proton relaxivity F. Yerly ; A. Borel ; L. Helm ; A. E. Merbach
Chemistry - A European Journal . 2003 . Vol. 9 , num. 22 , p. 5468-5480. DOI : 10.1002/chem.200305175. 2002 Gd(III) based MRI contrast agents: improved physical meaning in a combined analysis of EPR and NMR data? F. A. Dunand ; A. Borel ; L. Helm
Inorganic Chemistry Communications . 2002 . Vol. 5 , num. 10 , p. 811-815. DOI : 10.1016/S1387-7003(02)00575-0. How Does Internal Motion Influence the Relaxation of the Water Protons in LnIIIDOTA-like Complexes? F. A. Dunand ; A. Borel ; A. E. Merbach
Journal of the American Chemical Society . 2002 . Vol. 124 , num. 4 , p. 710-716. DOI : 10.1021/ja016873q. Multiexponential Electronic Spin Relaxation and Redfield's Limit in Gd(III) Complexes in Solution: Consequences for 17O/1H NMR and EPR Simultaneous Analysis A. Borel ; F. Yerly ; L. Helm ; A. E. Merbach
Journal of the American Chemical Society . 2002 . Vol. 124 , num. 9 , p. 2042-2048. DOI : 10.1021/ja016919f. T1e in Four Gd3+ Chelates: LODEPR Measurements and Models for Electron Spin Relaxation A. Borel ; L. Helm ; A. E. Merbach ; V. A. Atsarkin ; V. V. Demidov
et al.
Journal of Physical Chemistry A . 2002 . Vol. 106 , num. 26 , p. 6229-6231. DOI : 10.1021/jp0203752. 2001 Molecular dynamics simulation of Gadolinium(III) complexes in aqueous solution L. Helm ; F. Yerly ; A. Borel ; A. E. Merbach
Journal of Inorganic Biochemistry . 2001 . Vol. 86 , num. 1 , p. 57. DOI : 10.1016/S0162-0134(01)00251-3. A general approach to the electronic spin relaxation of Gd(III) complexes in solutions. Monte Carlo simulations beyond the Redfield limit S. Rast ; P. H. Fries ; E. Belorizky ; A. Borel ; L. Helm
et al.
Journal of Chemical Physics . 2001 . Vol. 115 , num. 16 , p. 7554-7563. DOI : 10.1063/1.1392364. EPR Spectroscopy of MRI-Related Gd(III) Complexes: Simultaneous Analysis of Multiple Frequency and Temperature Spectra, Including Static and Transient Crystal Field Effects S. Rast ; A. Borel ; L. Helm ; E. Belorizky ; P. H. Fries
et al.
Journal of the American Chemical Society . 2001 . Vol. 123 , num. 11 , p. 2637-2644. DOI : 10.1021/ja003707u. Molecular dynamics simulations of MRI-relevant GdIII chelates: direct access to outer-sphere relaxivity A. Borel ; L. Helm ; A. E. Merbach
Chemistry - A European Journal . 2001 . Vol. 7 , num. 3 , p. 600-610. DOI : 10.1002/1521-3765(20010202)7:3<600::AID-CHEM600>3.0.CO;2-H. 2000 EPR on aqueous Gd3+ complexes and a new analysis method considering both line widths and shifts A. Borel ; E. Toth ; L. Helm ; A. Janossy ; A. E. Merbach
Physical Chemistry Chemical Physics . 2000 . Vol. 2 , num. 6 , p. 1311-1317. DOI : 10.1039/a909553e. 1998 Développement d'agents de contraste de haute relaxivité pour l'Imagerie par Résonance Magnétique A. Borel ; I. van Uffelen ; L. Helm ; É. Tóth ; A. E. Merbach
1998 . Deuxième Colloque Franco-Québécois en Chimie Inorganique et Organométallique , Castres, France , 1997 . 1997 A Multinuclear NMR Study on the Structure and Dynamics of Lanthanide(III) Complexes of the Poly(amino carboxylate) EGTA4- in Aqueous Solution S. Aime ; A. Barge ; A. Borel ; M. Botta ; S. Chemerisov
et al.
Inorganic Chemistry . 1997 . Vol. 36 , num. 22 , p. 5104-5112. DOI : 10.1021/ic970240o. 1995 Etude du complexe [Pt2Cl4(mu-CO)2]2- par la théorie de la fonctionnelle de densité A. Borel
1995
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Enseignement & Phd
Cours
Understanding the theoretical foundations of information search.Efficient literature searching, (emphasis on chemical sources).Consequences on one's own publications.Practical management of search results with application to one's own PhD project.Current trends in scientific communication.