| Comparative study of defect reactivity in graphene PA Denis, F Iribarne The Journal of Physical Chemistry C 117 (37), 19048-19055, 2013 | 212 | 2013 |
| The chemotherapy of Chagas' disease: an overview M Paulino, F Iribarne, M Dubin, S Aguilera-Morales, O Tapia, ... Mini reviews in medicinal chemistry 5 (5), 499-519, 2005 | 129 | 2005 |
| Theoretical characterization of sulfur and nitrogen dual-doped graphene PA Denis, CP Huelmo, F Iribarne Computational and Theoretical Chemistry 1049, 13-19, 2014 | 88 | 2014 |
| Hydrogen storage in doped biphenylene based sheets PA Denis, F Iribarne Computational and theoretical chemistry 1062, 30-35, 2015 | 72 | 2015 |
| Monolayer and bilayer graphene functionalized with nitrene radicals PA Denis, F Iribarne The Journal of Physical Chemistry C 115 (1), 195-203, 2011 | 59 | 2011 |
| The 1, 3 dipolar cycloaddition of azomethine ylides to graphene, single wall carbon nanotubes, and C60 PA Denis, F Iribarne International Journal of Quantum Chemistry 110 (9), 1764-1771, 2010 | 55 | 2010 |
| On the hydrogen addition to graphene PA Denis, F Iribarne Journal of Molecular Structure: THEOCHEM 907 (1-3), 93-103, 2009 | 54 | 2009 |
| [2+ 2] Cycloadditions onto graphene PA Denis, F Iribarne Journal of Materials Chemistry 22 (12), 5470-5477, 2012 | 51 | 2012 |
| A first‐principles study on the interaction between alkyl radicals and graphene PA Denis, F Iribarne Chemistry–A European Journal 18 (24), 7568-7574, 2012 | 47 | 2012 |
| Thiophene adsorption on single wall carbon nanotubes and graphene PA Denis, F Iribarne Journal of Molecular Structure: THEOCHEM 957 (1-3), 114-119, 2010 | 46 | 2010 |
| Cooperative behavior in functionalized graphene: Explaining the occurrence of 1, 3 cycloaddition of azomethine ylides onto graphene PA Denis, F Iribarne Chemical Physics Letters 550, 111-117, 2012 | 38 | 2012 |
| Theoretical investigation on the interaction between beryllium, magnesium and calcium with benzene, coronene, cirumcoronene and graphene PA Denis, F Iribarne Chemical Physics 430, 1-6, 2014 | 32 | 2014 |
| Assaying phenothiazine derivatives as trypanothione reductase and glutathione reductase inhibitors by theoretical docking and molecular dynamics studies F Iribarne, M Paulino, S Aguilera, O Tapia Journal of Molecular Graphics and Modelling 28 (4), 371-381, 2009 | 31 | 2009 |
| Bond dissociation energies and enthalpies of formation of flavonoids: A G4 and M06-2X investigation E Alvareda, PA Denis, F Iribarne, M Paulino Computational and Theoretical Chemistry 1091, 18-23, 2016 | 30 | 2016 |
| Hydrogenated double wall carbon nanotubes PA Denis, F Iribarne, R Faccio The Journal of chemical physics 130 (19), 2009 | 30 | 2009 |
| Phenolic contents and antioxidant activity in central-southern Uruguayan propolis extracts M Paulino Zunini, C Rojas, S De Paula, I Elingold, E Alvareda Migliaro, ... Journal of the Chilean Chemical Society 55 (1), 141-146, 2010 | 29 | 2010 |
| New approach to accomplish the covalent functionalization of boron nitride nanosheets: cycloaddition reactions PA Denis, F Iribarne The Journal of Physical Chemistry C 122 (32), 18583-18587, 2018 | 26 | 2018 |
| C2V or C6V: Which is the most stable structure of the benzene–lithium complex? PA Denis, F Iribarne Chemical Physics Letters 573, 15-18, 2013 | 26 | 2013 |
| Computer assisted design of potentially active anti-trypanosomal compounds M Paulino, F Iribarne, M Hansz, M Vega, G Seoane, H Cerecetto, ... Journal of Molecular Structure: THEOCHEM 584 (1-3), 95-105, 2002 | 25 | 2002 |
| How is the stacking interaction of bilayer graphene affected by the presence of defects? PA Denis, R Faccio, F Iribarne Computational and Theoretical Chemistry 995, 1-7, 2012 | 24 | 2012 |
