| Investigation of thermal properties of DNA structure with precise atomic arrangement via equilibrium and non-equilibrium molecular dynamics approaches NA Jolfaei, NA Jolfaei, M Hekmatifar, A Piranfar, D Toghraie, R Sabetvand, ... Computer methods and programs in biomedicine 185, 105169, 2020 | 103 | 2020 |
| The molecular dynamics simulation of thermal manner of Ar/Cu nanofluid flow: the effects of spherical barriers size A Mosavi, M Hekmatifar, A Alizadeh, D Toghraie, R Sabetvand, ... Journal of Molecular Liquids 319, 114183, 2020 | 71 | 2020 |
| Studying temperature effects on electronic and optical properties of cubic CH3NH3SnI3 perovskite R Sabetvand, ME Ghazi, M Izadifard Journal of Computational Electronics 19, 70-79, 2020 | 55 | 2020 |
| Calculation of the thermal conductivity of human serum albumin (HSA) with equilibrium/non-equilibrium molecular dynamics approaches AZ Ashkezari, NA Jolfaei, NA Jolfaei, M Hekmatifar, D Toghraie, ... Computer methods and programs in biomedicine 188, 105256, 2020 | 51 | 2020 |
| Develop Molecular Dynamics Method to Simulate the Flow and Thermal Domains of H2O/Cu Nanofluid in a Nanochannel Affected by an External Electric Field A Asgari, Q Nguyen, A Karimipour, QV Bach, M Hekmatifar, R Sabetvand International Journal of Thermophysics 41, 1-14, 2020 | 45 | 2020 |
| The computational study of microchannel thickness effects on H2O/CuO nanofluid flow with molecular dynamics simulations Y Shang, RB Dehkordi, S Chupradit, D Toghraie, A Sevbitov, ... Journal of Molecular Liquids 345, 118240, 2022 | 44 | 2022 |
| The microchannel type effects on water-Fe3O4 nanofluid atomic behavior: Molecular dynamics approach X Hu, AH Derakhshanfard, I Patra, I Khalid, AT Jalil, MJC Opulencia, ... Journal of the Taiwan Institute of Chemical Engineers 135, 104396, 2022 | 39 | 2022 |
| Combustion process of nanofluids consisting of oxygen molecules and aluminum nanoparticles in a copper nanochannel using molecular dynamics simulation H Chen, D Bokov, S Chupradit, M Hekmatifar, MZ Mahmoud, ... Case Studies in Thermal Engineering 28, 101628, 2021 | 35 | 2021 |
| Prediction of the interaction between HIV viruses and human serum albumin (HSA) molecules using an equilibrium dynamics simulation program for application in bio medical science A Karimipour, A Karimipour, NA Jolfaei, M Hekmatifar, D Toghraie, ... Journal of Molecular Liquids 318, 113989, 2020 | 34 | 2020 |
| Investigation of the oxidation mechanism of dopamine functionalization in an AZ31 magnesium alloy for biomedical applications A Ghanbari, F Warchomicka, C Sommitsch, A Zamanian Coatings 9 (9), 584, 2019 | 31 | 2019 |
| Thermal analysis of hydration process in the vicinity of the Copper matrix using molecular dynamics simulation for application in thermal engineering W Cai, R Sabetvand, AM Abed, D Toghraie, M Hekmatifar, A Rahbari, ... Energy Reports 8, 7468-7475, 2022 | 29 | 2022 |
| Potential energy and atomic stability of H2O/CuO nanoparticles flow and heat transfer in non-ideal microchannel via molecular dynamic approach: the Green–Kubo … Y Zheng, X Zhang, MT Soleimani Mobareke, M Hekmatifar, A Karimipour, ... Journal of Thermal Analysis and Calorimetry 144, 2515-2523, 2021 | 29 | 2021 |
| The study of asphaltene desorption from the iron surface with molecular dynamics method M Hekmatifar, D Toghraie, A Khosravi, F Saberi, F Soltani, R Sabetvand, ... Journal of Molecular Liquids 318, 114325, 2020 | 28 | 2020 |
| Atomic rheology analysis of the external magnetic field effects on nanofluid in non-ideal microchannel via molecular dynamic method Y Zheng, X Zhang, M Nouri, A Amini, A Karimipour, M Hekmatifar, ... Journal of Thermal Analysis and Calorimetry 143, 1655-1663, 2021 | 26 | 2021 |
| Thermal performance of a phase change material (PCM) microcapsules containing Au nanoparticles in a nanochannel: a molecular dynamics approach F Wang, N Nasajpour-Esfahani, A Alizadeh, GF Smaisim, AM Abed, ... Journal of Molecular Liquids 373, 121128, 2023 | 25 | 2023 |
| Molecular dynamics simulation of water-based Ferro-nanofluid flow in the microchannel and nanochannel: Effects of number of layers and material of walls XY Shen, M Hekmatifar, MYA Shukor, A Alizadeh, YL Sun, D Toghraie, ... Journal of Molecular Liquids 338, 116924, 2021 | 25 | 2021 |
| Investigation of additives nanoparticles and sphere barriers effects on the fluid flow inside a nanochannel impressed by an extrinsic electric field: a molecular dynamics … A Asgari, Q Nguyen, A Karimipour, QV Bach, M Hekmatifar, R Sabetvand Journal of Molecular Liquids 318, 114023, 2020 | 24 | 2020 |
| The combustion process of methyl ester-biodiesel in the presence of different nanoparticles: a molecular dynamics approach Y Chen, A Alizadeh, AM Abed, N Nasajpour-Esfahani, GF Smaisim, ... Journal of Molecular Liquids 373, 121232, 2023 | 23 | 2023 |
| Investigation of dynamical behavior of 3LPT protein-water molecules interactions in atomic structures using molecular dynamics simulation M Ibrahim, T Saeed, M Hekmatifar, R Sabetvand, YM Chu, D Toghraie Journal of Molecular Liquids 329, 115615, 2021 | 19 | 2021 |
| Thermal and hydrodynamic properties of coronavirus at various temperature and pressure via molecular dynamics approach O Malekahmadi, A Zarei, MB Botlani Esfahani, M Hekmatifar, ... Journal of Thermal Analysis and Calorimetry 143, 2841-2850, 2021 | 19 | 2021 |
