화학공학소재연구정보센터
검색결과 : 23건
No. Article
1 Mechanistic Insights into Enantioselective Gold-Catalyzed Allylation of Indoles with Alcohols: The Counterion Effect
Bandini M, Bottoni A, Chiarucci M, Cera G, Miscione GP
Journal of the American Chemical Society, 134(51), 20690, 2012
2 Computational Evidence for the Catalytic Mechanism of Caspase-7. A DFT Investigation
Miscione GP, Calvaresi M, Bottoni A
Journal of Physical Chemistry B, 114(13), 4637, 2010
3 Deciphering Intrinsic Deactivation/Isomerization Routes in a Phytochrome Chromophore Model
Altoe P, Climent T, De Fusco GC, Stenta M, Bottoni A, Serrano-Andres L, Merchan M, Orlandi G, Garavelli M
Journal of Physical Chemistry B, 113(45), 15067, 2009
4 Electrostatic Control of the Photoisomerization Efficiency and Optical Properties in Visual Pigments: On the Role of Counterion Quenching
Tomasello G, Olaso-Gonzalez G, Altoe P, Stenta M, Serrano-Andres L, Merchan M, Orlandi G, Bottoni A, Garavelli M
Journal of the American Chemical Society, 131(14), 5172, 2009
5 The catalytic activity of proline racemase: A quantum mechanical/molecular mechanical study
Stenta M, Calvaresi M, Altoe P, Spinelli D, Garavelli M, Bottoni A
Journal of Physical Chemistry B, 112(4), 1057, 2008
6 Structure and stability of short beta-peptide nanotubes: A non-natural representative of collagen?
Czajlik A, Beke T, Bottoni A, Perczelt A
Journal of Physical Chemistry B, 112(26), 7956, 2008
7 Computational clues for a new mechanism in the glycosylase activity of the human DNA repair protein hOGG1. A generalized paradigm for purine-repairing systems?
Calvaresi M, Bottoni A, Garavelli M
Journal of Physical Chemistry B, 111(23), 6557, 2007
8 Convergent results from experimental and theoretical DFT studies of the intramolecular rearrangement of Z-hydrazones of 3-acyl-1,2,4-oxadiazoles
Bottoni A, Frenna V, Lanza CZ, Macaluso G, Spinelli D
Journal of Physical Chemistry A, 108(10), 1731, 2004
9 New model for a theoretical density functional theory investigation of the mechanism of the carbonic anhydrase: How does the internal bicarbonate rearrangement occur?
Bottoni A, Lanza CZ, Miscione GP, Spinelli D
Journal of the American Chemical Society, 126(5), 1542, 2004
10 DFT computational study of the mechanism of allyl halides carbonylation catalyzed by nickel tetracarbonyl
Bottoni A, Miscione GP, Novoa JJ, Prat-Resina X
Journal of the American Chemical Society, 125(34), 10412, 2003