| Hybrid density functional theory for π‐stacking interactions: Application to benzenes, pyridines, and DNA bases MP Waller, A Robertazzi, JA Platts, DE Hibbs, PA Williams Journal of computational chemistry 27 (4), 491-504, 2006 | 282 | 2006 |
| Oxygen-evolving Mn cluster in photosystem II: the protonation pattern and oxidation state in the high-resolution crystal structure A Galstyan, A Robertazzi, EW Knapp Journal of the American Chemical Society 134 (17), 7442-7449, 2012 | 175 | 2012 |
| Recent advances in anion–π interactions A Robertazzi, F Krull, EW Knapp, P Gamez CrystEngComm 13 (10), 3293-3300, 2011 | 173 | 2011 |
| Copper− 1, 10-phenanthroline complexes binding to DNA: structural predictions from molecular simulations A Robertazzi, AV Vargiu, A Magistrato, P Ruggerone, P Carloni, ... The Journal of Physical Chemistry B 113 (31), 10881-10890, 2009 | 98 | 2009 |
| The hydrolysis mechanism of the anticancer ruthenium drugs NAMI-A and ICR investigated by DFT− PCM calculations AV Vargiu, A Robertazzi, A Magistrato, P Ruggerone, P Carloni The Journal of Physical Chemistry B 112 (14), 4401-4409, 2008 | 97 | 2008 |
| Hydrogen bonding, solvation, and hydrolysis of cisplatin: A theoretical study A Robertazzi, JA Platts Journal of Computational Chemistry 25 (8), 1060-1067, 2004 | 82 | 2004 |
| A QM/MM study of cisplatin–DNA oligonucleotides: from simple models to realistic systems A Robertazzi, JA Platts Chemistry–A European Journal 12 (22), 5747-5756, 2006 | 76 | 2006 |
| Magnetic coupling between copper (II) ions mediated by hydrogen-bonded (neutral) water molecules J Tang, J Sánchez Costa, A Golobic, B Kozlevcar, A Robertazzi, ... Inorganic chemistry 48 (12), 5473-5479, 2009 | 71 | 2009 |
| Experimental Observation of Supramolecular Carbonyl-π/π-π/π-carbonyl and Carbonyl-π/π-π/π-anion Assemblies Supported by Theoretical Studies SR Choudhury, P Gamez, A Robertazzi, CY Chen, HM Lee, ... Crystal Growth and Design 8 (10), 3773-3784, 2008 | 67 | 2008 |
| Hydrogen bonding and covalent effects in binding of cisplatin to purine bases: ab initio and atoms in molecules studies A Robertazzi, JA Platts Inorganic chemistry 44 (2), 267-274, 2005 | 61 | 2005 |
| Density functional theory studies on copper phenanthroline complexes A Robertazzi, A Magistrato, P de Hoog, P Carloni, J Reedijk Inorganic chemistry 46 (15), 5873-5881, 2007 | 58 | 2007 |
| Gas-phase DNA oligonucleotide structures. A QM/MM and atoms in molecules study A Robertazzi, JA Platts The Journal of Physical Chemistry A 110 (11), 3992-4000, 2006 | 58 | 2006 |
| Nitrogen fixation by a molybdenum catalyst mimicking the function of the nitrogenase enzyme: A critical evaluation of DFT and solvent effects A Magistrato, A Robertazzi, P Carloni Journal of Chemical Theory and Computation 3 (5), 1708-1720, 2007 | 57 | 2007 |
| Concurrent anion⋯ π interactions between a perchlorate ion and two π-acidic aromatic rings, namely pentafluorophenol and 1, 3, 5-triazine RJ Götz, A Robertazzi, I Mutikainen, U Turpeinen, P Gamez, J Reedijk Chemical communications, 3384-3386, 2008 | 51 | 2008 |
| Binding of transition metal complexes to guanine and guanine–cytosine: hydrogen bonding and covalent effects A Robertazzi, JA Platts JBIC Journal of Biological Inorganic Chemistry 10, 854-866, 2005 | 43 | 2005 |
| Supramolecular lone pair− π/π− π/π− anion assembly in a Mg (II)− malonate− 2-aminopyridine− nitrate ternary system SR Choudhury, B Dey, S Das, P Gamez, A Robertazzi, KT Chan, HM Lee, ... The Journal of Physical Chemistry A 113 (8), 1623-1627, 2009 | 39 | 2009 |
| Breathing motions of a respiratory protein revealed by molecular dynamics simulations MA Scorciapino, A Robertazzi, M Casu, P Ruggerone, M Ceccarelli Journal of the American Chemical Society 131 (33), 11825-11832, 2009 | 33 | 2009 |
| Reprint of PSII Manganese Cluster: Protonation of W2, O5, O4 and His337 in the S1 state explored by combined quantum chemical and electrostatic energy computations A Robertazzi, A Galstyan, EW Knapp Biochimica et Biophysica Acta (BBA)-Bioenergetics 1837 (9), 1389-1394, 2014 | 31 | 2014 |
| Heme proteins: the role of solvent in the dynamics of gates and portals MA Scorciapino, A Robertazzi, M Casu, P Ruggerone, M Ceccarelli Journal of the American Chemical Society 132 (14), 5156-5163, 2010 | 27 | 2010 |
| Can oxidation states and the protonation pattern of oxomanganese complexes be recognized from their structures? A Robertazzi, A Galstyan, EW Knapp CrystEngComm 13 (21), 6369-6372, 2011 | 23 | 2011 |
