| Influence of the π–π interaction on the hydrogen bonding capacity of stacked DNA/RNA bases P Mignon, S Loverix, J Steyaert, P Geerlings Nucleic Acids Research 33 (6), 1779-1789, 2005 | 285 | 2005 |
| Influence of stacking on hydrogen bonding: quantum chemical study on pyridine− benzene model complexes P Mignon, S Loverix, F De Proft, P Geerlings The Journal of Physical Chemistry A 108 (28), 6038-6044, 2004 | 132 | 2004 |
| Ab initio molecular dynamics study of the hydration of Li+, Na+ and K+ in a montmorillonite model. Influence of isomorphic substitution P Mignon, P Ugliengo, M Sodupe, ER Hernandez Physical Chemistry Chemical Physics 12 (3), 688-697, 2010 | 117 | 2010 |
| Interplay between π–π interactions and the H-bonding ability of aromatic nitrogen bases P Mignon, S Loverix, P Geerlings Chemical physics letters 401 (1-3), 40-46, 2005 | 96 | 2005 |
| Theoretical Study of the Adsorption of RNA/DNA Bases on the External Surfaces of Na+-Montmorillonite P Mignon, P Ugliengo, M Sodupe The Journal of Physical Chemistry C 113 (31), 13741-13749, 2009 | 93 | 2009 |
| Effect of the π-π stacking interaction on the acidity of phenol A Olasz, P Mignon, F De Proft, T Veszprémi, P Geerlings Chemical physics letters 407 (4-6), 504-509, 2005 | 53 | 2005 |
| Theoretical study of the adsorption of DNA bases on the acidic external surface of montmorillonite P Mignon, M Sodupe Physical Chemistry Chemical Physics 14 (2), 945-954, 2012 | 47 | 2012 |
| Cooperative effects at water–crystalline silica interfaces strengthen surface silanol hydrogen bonding. An ab initio molecular dynamics study F Musso, P Mignon, P Ugliengo, M Sodupe Physical Chemistry Chemical Physics 14 (30), 10507-10514, 2012 | 46 | 2012 |
| A Periodic DFT Study of N2O4 Disproportionation on Alkali-Exchanged Zeolites X EA Pidko, P Mignon, P Geerlings, RA Schoonheydt, RA Van Santen The Journal of Physical Chemistry C 112 (14), 5510-5519, 2008 | 41 | 2008 |
| Dual descriptor and molecular electrostatic potential: complementary tools for the study of the coordination chemistry of ambiphilic ligands F Guégan, P Mignon, V Tognetti, L Joubert, C Morell Physical Chemistry Chemical Physics 16 (29), 15558-15569, 2014 | 39 | 2014 |
| DFT study of the fragmentation mechanism of uracil RNA base LS Arani, P Mignon, H Abdoul-Carime, B Farizon, M Farizon, H Chermette Physical Chemistry Chemical Physics 14 (28), 9855-9870, 2012 | 38 | 2012 |
| Acute aquatic toxicity of organic solvents modeled by QSARs A Levet, C Bordes, Y Clément, P Mignon, C Morell, H Chermette, ... Journal of molecular modeling 22, 1-14, 2016 | 37 | 2016 |
| Fragmentation mechanisms of cytosine, adenine and guanine ionized bases L Sadr-Arani, P Mignon, H Chermette, H Abdoul-Carime, B Farizon, ... Physical Chemistry Chemical Physics 17 (17), 11813-11826, 2015 | 36 | 2015 |
| Quantitative structure–activity relationship to predict acute fish toxicity of organic solvents A Levet, C Bordes, Y Clément, P Mignon, H Chermette, P Marote, ... Chemosphere 93 (6), 1094-1103, 2013 | 36 | 2013 |
| Understanding the concept of basicity in zeolites. A DFT study of the methylation of Al− O− Si bridging oxygen atoms P Mignon, P Geerlings, R Schoonheydt The Journal of Physical Chemistry B 110 (49), 24947-24954, 2006 | 35 | 2006 |
| Influence of stacking on the hydrogen bond donating potential of nucleic bases K Vanommeslaeghe, P Mignon, S Loverix, D Tourwe, P Geerlings Journal of Chemical Theory and Computation 2 (5), 1444-1452, 2006 | 35 | 2006 |
| New zinc phthalocyanine derivatives for nitrogen dioxide sensors: A theoretical optoelectronic investigation M Chaabene, B Gassoumi, P Mignon, RB Chaâbane, AR Allouche Journal of Molecular Graphics and Modelling 88, 174-182, 2019 | 31 | 2019 |
| Understanding the Reactivity and Basicity of Zeolites: A Periodic DFT Study of the Disproportionation of N2O4 on Alkali‐Cation‐Exchanged Zeolite Y P Mignon, EA Pidko, RA Van Santen, P Geerlings, RA Schoonheydt Chemistry–A European Journal 14 (17), 5168-5177, 2008 | 30 | 2008 |
| Theoretical and experimental study of the fragmentation of protonated uracil L Sadr-Arani, P Mignon, H Chermette, T Douki Chemical Physics Letters 605, 108-114, 2014 | 23 | 2014 |
| A Nucleophile Activation Dyad in Ribonucleases: a combined X-ray crystallographic/ab Initio quantum chemical study P Mignon, J Steyaert, R Loris, P Geerlings, S Loverix Journal of Biological Chemistry 277 (39), 36770-36774, 2002 | 23 | 2002 |
