Mechanistic insights into enantioselective gold-catalyzed allylation of indoles with alcohols: the counterion effect M Bandini, A Bottoni, M Chiarucci, G Cera, GP Miscione Journal of the American Chemical Society 134 (51), 20690-20700, 2012 | 147 | 2012 |
Amyloid-dependent triosephosphate isomerase nitrotyrosination induces glycation and tau fibrillation FX Guix, G Ill-Raga, R Bravo, T Nakaya, G de Fabritiis, M Coma, ... Brain 132 (5), 1335-1345, 2009 | 118 | 2009 |
DFT study of the olefin metathesis catalyzed by ruthenium complexes F Bernardi, A Bottoni, GP Miscione Organometallics 22 (5), 940-947, 2003 | 108 | 2003 |
New model for a theoretical density functional theory investigation of the mechanism of the carbonic anhydrase: how does the internal bicarbonate rearrangement occur? A Bottoni, CZ Lanza, GP Miscione, D Spinelli Journal of the American Chemical Society 126 (5), 1542-1550, 2004 | 98 | 2004 |
A Theoretical Study of Homogeneous Ziegler− Natta Catalysis F Bernardi, A Bottoni, GP Miscione Organometallics 17 (1), 16-24, 1998 | 85 | 1998 |
Asymmetric Phase‐Transfer‐Catalyzed Intramolecular N‐Alkylation of Indoles and Pyrroles: A Combined Experimental and Theoretical Investigation M Bandini, A Bottoni, A Eichholzer, GP Miscione, M Stenta Chemistry–A European Journal 16 (41), 12462-12473, 2010 | 76 | 2010 |
A DFT Study of the Simmons− Smith Cyclopropanation Reaction F Bernardi, A Bottoni, GP Miscione Journal of the American Chemical Society 119 (50), 12300-12305, 1997 | 59 | 1997 |
New computational evidence for the catalytic mechanism of carbonic anhydrase GP Miscione, M Stenta, D Spinelli, E Anders, A Bottoni Theoretical Chemistry Accounts 118, 193-201, 2007 | 51 | 2007 |
A theoretical DFT investigation of the lysozyme mechanism: computational evidence for a covalent intermediate pathway A Bottoni, GP Miscione, M De Vivo Proteins: Structure, Function, and Bioinformatics 59 (1), 118-130, 2005 | 50 | 2005 |
Methylglyoxal produced by amyloid-β peptide-induced nitrotyrosination of triosephosphate isomerase triggers neuronal death in Alzheimer's disease M Tajes, A Eraso-Pichot, F Rubio-Moscardo, B Guivernau, ... Journal of Alzheimer's Disease 41 (1), 273-288, 2014 | 48 | 2014 |
DFT Study of the palladium-catalyzed cyclopropanation reaction F Bernardi, A Bottoni, GP Miscione Organometallics 20 (13), 2751-2758, 2001 | 42 | 2001 |
A DFT computational study of the bis-silylation reaction of acetylene catalyzed by palladium complexes A Bottoni, AP Higueruelo, GP Miscione Journal of the American Chemical Society 124 (19), 5506-5513, 2002 | 41 | 2002 |
Metal carbene or carbenoid complexes? A theoretical study of the active form of transition metal catalysts in cyclopropanation and olefin metathesis reactions F Bernardi, A Bottoni, GP Miscione Organometallics 19 (25), 5529-5532, 2000 | 38 | 2000 |
Gold (I)‐assisted α‐allylation of Enals and Enones with Alcohols MM Mastandrea, N Mellonie, P Giacinto, A Collado, SP Nolan, ... Angewandte Chemie International Edition 54 (49), 14885-14889, 2015 | 30 | 2015 |
Bis (oxazoline) titanium complexes as chiral catalysts for enantioselective hydrosilylation of ketones− a combined experimental and theoretical investigation M Bandini, F Bernardi, A Bottoni, PG Cozzi, GP Miscione, ... European Journal of Organic Chemistry 2003 (15), 2972-2984, 2003 | 27 | 2003 |
Gold (I)‐Catalyzed Dearomative [2+ 2]‐Cycloaddition of Indoles with Activated Allenes: A Combined Experimental–Computational Study R Ocello, A De Nisi, M Jia, QQ Yang, M Monari, P Giacinto, A Bottoni, ... Chemistry–A European Journal 21 (50), 18445-18453, 2015 | 24 | 2015 |
DFT computational study of the mechanism of allyl halides carbonylation catalyzed by nickel tetracarbonyl A Bottoni, GP Miscione, JJ Novoa, X Prat-Resina Journal of the American Chemical Society 125 (34), 10412-10419, 2003 | 24 | 2003 |
Covalent or Non‐Covalent? A Mechanistic Insight into the Enantioselective Brønsted Acid Catalyzed Dearomatization of Indoles with Allenamides P Giacinto, A Bottoni, A Garelli, GP Miscione, M Bandini ChemCatChem 10 (11), 2442-2449, 2018 | 22 | 2018 |
Synthesis of 1, 3-diols by O-nucleophile additions to activated alkenes D Gamba-Sánchez, J Prunet Synthesis 50 (20), 3997-4007, 2018 | 19 | 2018 |
Computational evidence for the catalytic mechanism of caspase-7. A DFT investigation GP Miscione, M Calvaresi, A Bottoni The Journal of Physical Chemistry B 114 (13), 4637-4645, 2010 | 19 | 2010 |