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41. F. Tajik and A. Namiranian,
Differential conductance of armchair single-wall carbon nanotubes due to presence of electron-phonon interaction,
Physica E 84(2016), 79  [abstract]   
 
42. S. Jalili, M. Maddah and J . Schofield,
Molecular dynamics simulation and free energy analysis of the interaction of platinum-based anti-cancer drugs with DNA,
Journal of Theoretical and Computational Chemistry 15(2016), 1650054-1  [abstract]   
 
43. Z. Beiranvand, A. Kakanejadifard, I. S. Donskyi, A. Faghani, Z. Tu, A. Lippitz, P. Sasanpour, F. Maschietto, B. Paulus, W. E. S. Unger, R. Haag and M. Adeli,
Functionalization of fullerene at room temperature: toward new carbon vectors with improved physicochemical properties,
RSC Adv. 6(2016), 112771  [abstract]   
 
44. Z. Fallah, Y. Jamali and H. Rafii Tabar,
Structural and Functional Effect of an Oscillating Electric Field on the Dopamine-D3 Receptor: A Molecular Dynamics Simulation Study,
Plos One 11(2016), 1  [abstract]   
 
45. M. Goli and Sh. Shahbazian,
Extending the Domain-Averaged Exchange-Correlation Energies Within the Context of the MC-QTAIM: Tracing Subtle Variations Induced by Isotope Substitution,
Chem.Phys.Chem 17(2016), 3875  [abstract]   
 
46. H. Rostami, A. G. Moghaddam and R. Asgari,
Spin relaxation and the Kondo effect in transition metal dichalcogenide monolayers,
J. Physics: Condens. Matter 28(2016), 505002(1-11)  [abstract]   
 
47. T. Takieh, P. Sasanpour and H. Rafii Tabar,
Neurophysiological Effect of External Electromagnetic Field: A Computational Modeling,
NANO: Brief Repo. and Rev. 11(2016), 1650111(1-9)  [abstract]   
 
48. F. Faraji and A. Rajabpour,
Temperature gradient-induced fluid pumping inside a single-wall carbon nanotube: A non-equilibrium molecular dynamics study,
Phys. Fluids 28(2016), 092004(1-12)  [abstract]   
 
49. A. Ryabov, V. Holubec, M. H . Yaghoubi, M . Varga, M. E . Foulaadvand and P . Chvosta,
Transport coefficients for a confined Brownian ratchet operating between two heat reservoirs,
J.Stat. Mech: Theory and Experiments 2016(2016), 1-25  [abstract]   
 
50. N. Sakhaee and S. Jalili,
Do coordinating and solvating effects of H2 explain high concentrations of H3+ in interstellar dense clouds? A molecular orbital study of hydrogen cluster ions H3+ to H21+,
J. Iran. Chem. Society 13(2016), 1561  [abstract]   
 

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