화학공학소재연구정보센터
검색결과 : 14건
No. Article
1 Efficient and Accurate Modeling of Conformational Transitions in Proteins: The Case of c-Src Kinase
Milanetti E, Trandafir AG, Alba J, Raimondo D, D'Abramo M
Journal of Physical Chemistry B, 122(38), 8853, 2018
2 Equilibrium between 5-and 6-Fold Coordination in the First Hydration Shell of Cu(II)
Chillemi G, Pace E, D'Abramo M, Benfatto M
Journal of Physical Chemistry A, 120(22), 3958, 2016
3 Theoretical calculation of the pyrene emission properties in different solvents
D'Abramo M, Aschi M, Amadei A
Chemical Physics Letters, 639, 17, 2015
4 On the Nature of DNA Hyperchromic Effect
D'Abramo M, Castellazzi CL, Orozco M, Amadei A
Journal of Physical Chemistry B, 117(29), 8697, 2013
5 Kinetics of Carbon Monoxide Migration and Binding in Solvated Myoglobin as Revealed by Molecular Dynamics Simulations and Quantum Mechanical Calculations
D'Abramo M, Di Nola A, Amadei A
Journal of Physical Chemistry B, 113(51), 16346, 2009
6 Theoretical Characterization of the Dynamical Behavior and Transport Properties of alpha,gamma-Peptide Nanotubes in Solution
Garcia-Fandino R, Granja JR, D'Abramo M, Orozco M
Journal of the American Chemical Society, 131(43), 15678, 2009
7 Theoretical study of intramolecular charge transfer in pi-conjugated oligomers
Amadei A, D'Abramo M, Di Nola A, Arcadi A, Cerichelli G, Aschi M
Chemical Physics Letters, 434(4-6), 194, 2007
8 On the importance of configurational sampling in theoretical calculation of electronic properties of complex molecular systems: Acetone in water
D'Abramo M, Aschi M, Di Nola A, Amadei A
Chemical Physics Letters, 424(4-6), 289, 2006
9 Calculation of the optical rotatory dispersion of solvated alanine by means of the perturbed matrix method
D'Abramo M, Aschi M, Di Nola A, Amadei A
Chemical Physics Letters, 402(4-6), 559, 2005
10 Theoretical characterization of alpha-helix and beta-hairpin folding kinetics
Daidone I, D'Abramo M, Di Nola A, Amadei A
Journal of the American Chemical Society, 127(42), 14825, 2005