STENTA, MARCO
STENTA, MARCO
DIP. DI CHIMICA "G.CIAMICIAN"
A Novel Approach to the Evaluation of the Importance of Steric and Electronic Effects in SNAr Reactions: A Computational, Thermodynamic and 1H and 13C NMR Study of "Meisenheimer-Type" Adducts in the Benzo[b]thiophene Series.
2010 G. Consiglio; B. Cosimelli; S. Guernelli; C. Z. Lanza; F. Sancassan; D. Spinelli; M. Stenta.
A tunable QM/MM approach to chemical reactivity, structure and physico-chemical properties prediction
2007 P. Altoè; M. Stenta; A. Bottoni; M. Garavelli
Adenine deactivation in DNA resolved at the CASPT2//CASSCF/AMBER level
2010 I. Conti; P. Altoe`; M. Stenta; M. Garavelli; G. Orlandi
Asymmetric Phase-Transfer-Catalyzed Intramolecular N-Alkylation of Indoles and Pyrroles: A Combined Experimental and Theoretical Investigation
2010 M. Bandini; A. Bottoni; A. Eichholzer; G. P. Miscione; M. Stenta
Catalytic Mechanism of Diaminopimelate Epimerase: A QM/MM Investigation
2009 M. Stenta; M. Calvaresi; P. Altoè; D. Spinelli; M. Garavelli; R. Galeazzi; A. Bottoni
COBRAMM (part 1): a Tunable QM/MM Approach to Chemical Reactivity, Structure and Physico-Chemical Properties Prediction
2007 Altoè, P.; Stenta, Marco; Bottoni, Andrea; Garavelli, Marco
COBRAMM (part 2): an Overview on Some Computational Details; Geometry Optimization, Frequency Calculation, Analysis of the Results
2007 Stenta, Marco; Altoè, P.; Bottoni, Andrea; Garavelli, Marco
COBRAMM: A Tunable QM/MM Approach to Complex Molecular Architectures. Modelling the Excited and Ground State Properties of Sized Molecular Systems
2007 Altoè, P.; Stenta, Marco; Bottoni, Andrea; Garavelli, Marco
Common catalytic features among cofactor independent racemases and epimerases: A computational perspective
2010 Stenta M.; Altoe P.; Dal Peraro M.; Garavelli M.; Bottoni A.
Computational QM/MM Study of the Reaction Mechanism of Human Glutathione S-Transferase A3-3
2007 Calvaresi, Matteo; Stenta, Marco; Altoè, P.; Bottoni, Andrea; Garavelli, Marco; Spinelli, Domenico
Deciphering Intrinsic Deactivation/Isomerization Routes in a Phytochrome Chromophore Model
2009 P. Altoé; T. Climent; G. C. De Fusco; M. Stenta; A. Bottoni; L. Serrano-Andrés; M. Merchàn; G. Orlandi; M. Garavelli
Retinal Photoisomerization in Rhodopsin: Electrostatic and Steric Catalysis
2007 Tomasello, Gaia; Altoè, P.; Stenta, Marco; Olaso González, G.; Garavelli, Marco; Orlandi, Giorgio
Rhodopsin and GFP Chromophores: QM/MM Absorption Spectra in Solvent and Protein
2007 Altoè, P.; Stenta, Marco; Garavelli, Marco
Shedding a new light on photolyases: Accurate molecular modeling as a tool for undestanding DNA repairing enzymes
2010 Stenta M.; Dal Peraro M.; Garavelli M.; Altoe P.; Di Domenico M.; Bottoni A.
Substituent effect on the electrochemical behaviour of some ortho-substituted (aryl)(2-nitrobenzo[b]thiophen-3-yl)amines. A combined experimental and computational study
2006 A. Bottoni; B. Cosimelli; E. Scavetta; D. Spinelli; R. Spisani; M. Stenta; D. Tonelli
Synthesis of Ethyl 5-Hydroxyisoxazolidine-4-carboxylates via Michael Addition/Intramolecular Hemiketalisation
2008 F. Benfatti; A. Bottoni; L. Gentilucci; M. Monari; E. Mosconi; M. Stenta; A. Tolomelli
The Catalytic Activity of Diaminopimelate Epimerase: a QM/MM Study
2007 Stenta, Marco; Calvaresi, Matteo; Altoè, P.; Spinelli, Domenico; Garavelli, Marco; Bottoni, Andrea
The Catalytic Activity of Proline Racemase: a QM/MM Study
2007 Stenta, Marco; Calvaresi, Matteo; Altoè, P.; Spinelli, Domenico; Garavelli, Marco; Bottoni, Andrea
The Catalytic Activity of Proline Racemase: a QM/MM Study
2008 M. Stenta; M. Calvaresi; P. Altoè; D. Spinelli; M. Garavelli; A. Bottoni
The cycloaddition reaction between alpha-bromo vinylketenes and imines: a combined experimental and theoretical study.
2008 F. Benfatti; A. Bottoni; G. Cardillo; S. Fabbroni; L. Gentilucci; M. Stenta; A. Tolomelli
| Titolo | Autore(i) | Anno | Periodico | Editore | Tipo | File |
|---|---|---|---|---|---|---|
| A Novel Approach to the Evaluation of the Importance of Steric and Electronic Effects in SNAr Reactions: A Computational, Thermodynamic and 1H and 13C NMR Study of "Meisenheimer-Type" Adducts in the Benzo[b]thiophene Series. | G. Consiglio; B. Cosimelli; S. Guernelli; C. Z. Lanza; F. Sancassan; D. Spinelli; M. Stenta. | 2010-01-01 | EUROPEAN JOURNAL OF ORGANIC CHEMISTRY | - | 1.01 Articolo in rivista | - |
| A tunable QM/MM approach to chemical reactivity, structure and physico-chemical properties prediction | P. Altoè; M. Stenta; A. Bottoni; M. Garavelli | 2007-01-01 | THEORETICAL CHEMISTRY ACCOUNTS | - | 1.01 Articolo in rivista | - |
| Adenine deactivation in DNA resolved at the CASPT2//CASSCF/AMBER level | I. Conti; P. Altoe`; M. Stenta; M. Garavelli; G. Orlandi | 2010-01-01 | PHYSICAL CHEMISTRY CHEMICAL PHYSICS | - | 1.01 Articolo in rivista | - |
| Asymmetric Phase-Transfer-Catalyzed Intramolecular N-Alkylation of Indoles and Pyrroles: A Combined Experimental and Theoretical Investigation |
M. Bandini; A. Bottoni; A. Eichholzer; G. P. Miscione; M. Stenta |
2010-01-01 | CHEMISTRY-A EUROPEAN JOURNAL | - | 1.01 Articolo in rivista | - |
| Catalytic Mechanism of Diaminopimelate Epimerase: A QM/MM Investigation | M. Stenta; M. Calvaresi; P. Altoè; D. Spinelli; M. Garavelli; R. Galeazzi; A. Bottoni | 2009-01-01 | JOURNAL OF CHEMICAL THEORY AND COMPUTATION | - | 1.01 Articolo in rivista | - |
| COBRAMM (part 1): a Tunable QM/MM Approach to Chemical Reactivity, Structure and Physico-Chemical Properties Prediction | Altoè, P.; Stenta, Marco; Bottoni, Andrea; Garavelli, Marco | 2007-01-01 | - | American Institute Of Physics | 4.01 Contributo in Atti di convegno | - |
| COBRAMM (part 2): an Overview on Some Computational Details; Geometry Optimization, Frequency Calculation, Analysis of the Results | Stenta, Marco; Altoè, P.; Bottoni, Andrea; Garavelli, Marco | 2007-01-01 | - | American Institute Of Physics | 4.01 Contributo in Atti di convegno | - |
| COBRAMM: A Tunable QM/MM Approach to Complex Molecular Architectures. Modelling the Excited and Ground State Properties of Sized Molecular Systems | Altoè, P.; Stenta, Marco; Bottoni, Andrea; Garavelli, Marco | 2007-01-01 | - | American Institute Of Physics | 4.01 Contributo in Atti di convegno | - |
| Common catalytic features among cofactor independent racemases and epimerases: A computational perspective | Stenta M.; Altoe P.; Dal Peraro M.; Garavelli M.; Bottoni A. | 2010-01-01 | ABSTRACTS OF PAPERS - AMERICAN CHEMICAL SOCIETY | ACS | 4.02 Riassunto (Abstract) | - |
| Computational QM/MM Study of the Reaction Mechanism of Human Glutathione S-Transferase A3-3 | Calvaresi, Matteo; Stenta, Marco; Altoè, P.; Bottoni, Andrea; Garavelli, Marco; Spinelli, Domenico | 2007-01-01 | - | American Institute Of Physics | 4.01 Contributo in Atti di convegno | - |
| Deciphering Intrinsic Deactivation/Isomerization Routes in a Phytochrome Chromophore Model | P. Altoé; T. Climent; G. C. De Fusco; M. Stenta; A. Bottoni; L. Serrano-Andrés; M. Merchàn; G. Or...landi; M. Garavelli | 2009-01-01 | JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL | - | 1.01 Articolo in rivista | - |
| Retinal Photoisomerization in Rhodopsin: Electrostatic and Steric Catalysis | Tomasello, Gaia; Altoè, P.; Stenta, Marco; Olaso González, G.; Garavelli, Marco; Orlandi, Giorgio | 2007-01-01 | - | American Institute Of Physics | 4.01 Contributo in Atti di convegno | - |
| Rhodopsin and GFP Chromophores: QM/MM Absorption Spectra in Solvent and Protein | Altoè, P.; Stenta, Marco; Garavelli, Marco | 2007-01-01 | - | American Institute Of Physics | 4.01 Contributo in Atti di convegno | - |
| Shedding a new light on photolyases: Accurate molecular modeling as a tool for undestanding DNA repairing enzymes | Stenta M.; Dal Peraro M.; Garavelli M.; Altoe P.; Di Domenico M.; Bottoni A. | 2010-01-01 | ABSTRACTS OF PAPERS - AMERICAN CHEMICAL SOCIETY | ACS | 4.02 Riassunto (Abstract) | - |
| Substituent effect on the electrochemical behaviour of some ortho-substituted (aryl)(2-nitrobenzo[b]thiophen-3-yl)amines. A combined experimental and computational study | A. Bottoni; B. Cosimelli; E. Scavetta; D. Spinelli; R. Spisani; M. Stenta; D. Tonelli | 2006-01-01 | MOLECULAR PHYSICS | - | 1.01 Articolo in rivista | - |
| Synthesis of Ethyl 5-Hydroxyisoxazolidine-4-carboxylates via Michael Addition/Intramolecular Hemiketalisation | F. Benfatti; A. Bottoni; L. Gentilucci; M. Monari; E. Mosconi; M. Stenta; A. Tolomelli | 2008-01-01 | EUROPEAN JOURNAL OF ORGANIC CHEMISTRY | - | 1.01 Articolo in rivista | - |
| The Catalytic Activity of Diaminopimelate Epimerase: a QM/MM Study | Stenta, Marco; Calvaresi, Matteo; Altoè, P.; Spinelli, Domenico; Garavelli, Marco; Bottoni, Andrea | 2007-01-01 | - | American Institute Of Physics | 4.01 Contributo in Atti di convegno | - |
| The Catalytic Activity of Proline Racemase: a QM/MM Study | Stenta, Marco; Calvaresi, Matteo; Altoè, P.; Spinelli, Domenico; Garavelli, Marco; Bottoni, Andrea | 2007-01-01 | - | American Institute Of Physics | 4.01 Contributo in Atti di convegno | - |
| The Catalytic Activity of Proline Racemase: a QM/MM Study | M. Stenta; M. Calvaresi; P. Altoè; D. Spinelli; M. Garavelli; A. Bottoni | 2008-01-01 | JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL | - | 1.01 Articolo in rivista | - |
| The cycloaddition reaction between alpha-bromo vinylketenes and imines: a combined experimental and theoretical study. | F. Benfatti; A. Bottoni; G. Cardillo; S. Fabbroni; L. Gentilucci; M. Stenta; A. Tolomelli | 2008-01-01 | ADVANCED SYNTHESIS & CATALYSIS | - | 1.01 Articolo in rivista | - |