E-LIB Suche - Ergebnisse für: Polimeno, Antonino

1

The roto-conformational diffusion tensor as a tool to inter..:

Rampino, Sergio ; Zerbetto, Mirco ; Polimeno, Antonino
Physical Chemistry Chemical Physics. 25 (2023) 21 - p. 14822-14835 , 2023

Link: https://doi.org/10.1039/..

2

Intrinsic Flexibility beyond the Highly Ordered DNA Tetrahe..:

Zerbetto, Mirco ; Saint-Pierre, Christine ; Piserchia, Andrea...
The Journal of Physical Chemistry Letters. 14 (2023) 44 - p. 10032-10038 , 2023

Link: https://doi.org/10.1021/..

3

Analysis of Velocity Autocorrelation Functions from Molecul..:

Abergel, Daniel ; Polimeno, Antonino ; Zerbetto, Mirco
The Journal of Physical Chemistry B. 127 (2023) 50 - p. 10896-10902 , 2023

Link: https://doi.org/10.1021/..

4

Parameter free evaluation of SN2 reaction rates for halide ..:

Bortoli, Marco ; Campeggio, Jonatan ; Orian, Laura..
Physical Chemistry Chemical Physics. 24 (2022) 12 - p. 7474-7480 , 2022

Link: https://doi.org/10.1039/..

5

Enabling Circular Economy: The Overlooked Role of Inorganic..:

Salviulo, Gabriella ; Lavagnolo, Maria Cristina ; Dabalà, Manuele...
Chemistry – A European Journal. 27 (2021) 22 - p. 6676-6695 , 2021

Link: https://doi.org/10.1002/..

6

Stochastic Modelling of 13C NMR Spin Relaxation Experiments..:

Rampino, Sergio ; Zerbetto, Mirco ; Polimeno, Antonino
Molecules. 26 (2021) 9 - p. 2418 , 2021

Link: https://doi.org/10.3390/..

7

Multiscale modeling of reaction rates: application to arche..:

Campeggio, Jonathan ; Bortoli, Marco ; Orian, Laura..
Physical Chemistry Chemical Physics. 22 (2020) 6 - p. 3455-3465 , 2020

Link: https://doi.org/10.1039/..

8

Glycosidic linkage flexibility: The ψ torsion angle has a b..:

Zerbetto, Mirco ; Polimeno, Antonino ; Widmalm, Göran
The Journal of Chemical Physics. 152 (2020) 3 - p. , 2020

Link: https://doi.org/10.1063/..

9

Modelling of Ca2+-promoted structural effects in wild type ..:

Calligari, Paolo ; Torsello, Mauro ; Bortoli, Marco..
Molecular Simulation. 46 (2019) 3 - p. 235-245 , 2019

Link: https://doi.org/10.1080/..

10

Evaluating rotation diffusion properties of molecules from ..:

Polimeno, Antonino ; Zerbetto, Mirco
Physical Chemistry Chemical Physics. 21 (2019) 7 - p. 3662-3668 , 2019

Link: https://doi.org/10.1039/..

11

Stochastic modeling of macromolecules in solution. I. Relax..:

Polimeno, Antonino ; Zerbetto, Mirco ; Abergel, Daniel
The Journal of Chemical Physics. 150 (2019) 18 - p. , 2019

Link: https://doi.org/10.1063/..

12

Stochastic modeling of macromolecules in solution. II. Spec..:

Polimeno, Antonino ; Zerbetto, Mirco ; Abergel, Daniel
The Journal of Chemical Physics. 150 (2019) 18 - p. , 2019

Link: https://doi.org/10.1063/..

13

Similarity and Specificity of Chlorophyll b Triplet State i..:

Agostini, Alessandro ; Dal Farra, Maria Giulia ; Paulsen, Harald...
The Journal of Physical Chemistry B. 123 (2019) 39 - p. 8232-8239 , 2019

Link: https://doi.org/10.1021/..

14

Differential Dynamics at Glycosidic Linkages of an Oligosac..:

Zerbetto, Mirco ; Angles d'Ortoli, Thibault ; Polimeno, Antonino.
The Journal of Physical Chemistry B. 122 (2018) 8 - p. 2287-2294 , 2018

Link: https://doi.org/10.1021/..

15

DiTe2: Calculating the diffusion tensor for flexible molecu..:

Campeggio, Jonathan ; Polimeno, Antonino ; Zerbetto, Mirco
Journal of Computational Chemistry. 40 (2018) 4 - p. 697-705 , 2018

Link: https://doi.org/10.1002/..