| The singlet and triplet states of phenyl cation. A hybrid approach for locating minimum energy crossing points between non-interacting potential energy surfaces JN Harvey, M Aschi, H Schwarz, W Koch Theoretical Chemistry Accounts 99, 95-99, 1998 | 963 | 1998 |
| Spin-forbidden dehydrogenation of methoxy cation: a statistical view JN Harvey, M Aschi Physical Chemistry Chemical Physics 1 (24), 5555-5563, 1999 | 320 | 1999 |
| Antimicrobial peptides: natural templates for synthetic membrane-active compounds A Giuliani, G Pirri, A Bozzi, A Di Giulio, M Aschi, AC Rinaldi Cellular and Molecular Life Sciences 65, 2450-2460, 2008 | 230 | 2008 |
| Gold-Catalyzed Reactions of 2-Alkynyl-phenylamines with α, β-Enones M Alfonsi, A Arcadi, M Aschi, G Bianchi, F Marinelli The Journal of Organic Chemistry 70 (6), 2265-2273, 2005 | 207 | 2005 |
| Modelling spin-forbidden reactions: recombination of carbon monoxide with iron tetracarbonyl JN Harvey, M Aschi Faraday Discussions 124, 129-143, 2003 | 197 | 2003 |
| HCN Synthesis from Methane and Ammonia: Mechanisms of Pt+-Mediated C−N Coupling M Diefenbach, M Brönstrup, M Aschi, D Schröder, H Schwarz Journal of the American Chemical Society 121 (45), 10614-10625, 1999 | 139 | 1999 |
| A first-principles method to model perturbed electronic wavefunctions: the effect of an external homogeneous electric field M Aschi, R Spezia, A Di Nola, A Amadei Chemical physics letters 344 (3-4), 374-380, 2001 | 138 | 2001 |
| Crystal structure of the peroxisome proliferator-activated receptor γ (PPARγ) ligand binding domain complexed with a novel partial agonist: a new region of the hydrophobic … R Montanari, F Saccoccia, E Scotti, M Crestani, C Godio, F Gilardi, ... Journal of medicinal chemistry 51 (24), 7768-7776, 2008 | 128 | 2008 |
| A Gas‐Phase Model for the Pt+‐Catalyzed Coupling of Methane and Ammonia M Aschi, M Brönstrup, M Diefenbach, JN Harvey, D Schröder, H Schwarz Angewandte Chemie International Edition 37 (6), 829-832, 1998 | 93 | 1998 |
| The Reversible Opening of Water Channels in Cytochrome c Modulates the Heme Iron Reduction Potential CA Bortolotti, A Amadei, M Aschi, M Borsari, S Corni, M Sola, I Daidone Journal of the American Chemical Society 134 (33), 13670-13678, 2012 | 80 | 2012 |
| Theoretical characterization of electronic states in interacting chemical systems A Amadei, M D’Alessandro, M D’Abramo, M Aschi The Journal of chemical physics 130 (8), 2009 | 72 | 2009 |
| Pd-catalyzed regioselective hydroarylation of α-(2-aminoaryl)-α, β-ynones with organoboron derivatives as a tool for the synthesis of quinolines: experimental evidence and … A Arcadi, M Aschi, F Marinelli, M Verdecchia Tetrahedron 64 (22), 5354-5361, 2008 | 71 | 2008 |
| Experimental and computational study of neutral xenon halides (XeX) in the gas phase for X= F, Cl, Br, and I D Schröder, JN Harvey, M Aschi, H Schwarz The Journal of chemical physics 108 (20), 8446-8455, 1998 | 70 | 1998 |
| Spin isomerisation of para-substituted phenyl cations M Aschi, JN Harvey Journal of the Chemical Society, Perkin Transactions 2, 1059-1062, 1999 | 67 | 1999 |
| Does adsorption at hydroxyapatite surfaces induce peptide folding? Insights from large-scale B3LYP calculations A Rimola, M Aschi, R Orlando, P Ugliengo Journal of the American Chemical Society 134 (26), 10899-10910, 2012 | 59 | 2012 |
| Structural insight into peroxisome proliferator-activated receptor γ binding of two ureidofibrate-like enantiomers by molecular dynamics, cofactor interaction analysis, and … G Pochetti, N Mitro, A Lavecchia, F Gilardi, N Besker, E Scotti, M Aschi, ... Journal of medicinal chemistry 53 (11), 4354-4366, 2010 | 57 | 2010 |
| Cation–π interactions between ammonium ion and aromatic rings: an energy decomposition study M Aschi, F Mazza, A Di Nola Journal of Molecular Structure: THEOCHEM 587 (1-3), 177-188, 2002 | 57 | 2002 |
| Physicochemical Properties of Fluorescent Probes: Experimental and Computational Determination of the Overlapping pKa Values of Carboxyfluorescein M Aschi, AA D’Archivio, A Fontana, A Formiglio The Journal of organic chemistry 73 (9), 3411-3417, 2008 | 55 | 2008 |
| Extension of the perturbed matrix method: application to a water molecule R Spezia, M Aschi, A Di Nola, A Amadei Chemical physics letters 365 (5-6), 450-456, 2002 | 55 | 2002 |
| Extending the perturbed matrix method beyond the dipolar approximation: comparison of different levels of theory L Zanetti-Polzi, S Del Galdo, I Daidone, M D'Abramo, V Barone, M Aschi, ... Physical Chemistry Chemical Physics 20 (37), 24369-24378, 2018 | 53 | 2018 |
