| 61 | PNIPAM/Hexakis as a thermosensitive drug delivery system for biomedical and pharmaceutical applications (vol 12, 14363, 2022) | _ | Scientific Reports | 2022 |
| 62 | Conjugation of a smart polymer to doxorubicin through a pH-responsive bond for targeted drug delivery and improving drug loading on graphene oxide† | َAli Bina | RSC Advances | 2021 |
| 63 | Design of new drug delivery platform based on surface functionalization of black phosphorus nanosheet with a smart polymer for enhancing the efficiency of doxorubicin in the treatment of cancer | _ | Journal of Biomedical Materials Research Part A | 2021 |
| 64 | Nanotechnology-based approaches for targeting and delivery of drugs via Hexakis (m-PE) macrocycles | _ | Scientific Reports | 2021 |
| 65 | Design of a new drug delivery platform based on surface functionalization 2D covalent organic frameworks | afsaneh ghahari | Journal of the Taiwan Institute of Chemical Engineers | 2021 |
| 66 | Assessment of the effect of external and internal triggers on adsorption and release of paclitaxel from the PEI functionalized silicene nanosheet: A molecular dynamic simulation | seyede leila Razavi Khoosfi | Journal of Molecular Graphics and Modelling | 2021 |
| 67 | Molecular interpretation of the carbon nitride performance as a template for the transport of anti-cancer drug into the biological membrane | ameneh zaboli arbab din mohamad | Scientific Reports | 2021 |
| 68 | Influence of high-electronegativity atoms on the 7 Be decay rate | Mohammad Mehdi Firoozabadi | Physical Review C | 2020 |
| 69 | Stabilization of d-lactate dehydrogenase diagnostic enzyme via immobilization on pristine and carboxyl-functionalized carbon nanotubes, a combined experimental and molecular dynamics simulation study | Torkzadeh-Mahani Masoud,Zaboli Mahdiye | ARCHIVES OF BIOCHEMISTRY AND BIOPHYSICS | 2019 |
| 70 | Comparative prediction of binding affinity of Hydroxyurea anti-cancer to boron nitride and carbon nanotubes as smart targeted drug delivery vehicles | Mortazavifar Azam | Journal of Biomolecular Structure and Dynamics | 2019 |
| 71 | Understanding loading, diffusion and releasing of Doxorubicin and Paclitaxel dual delivery in graphene and graphene oxide carriers as highly efficient drug delivery systems | _ | Applied Surface Science | 2019 |
| 72 | Molecular Insight into Adsorption Affinities of Carmustine Drug on Boron and Nitrogen Doped Functionalized Single-walled Carbon Nanotubes Using Density Functional Theory Including Dispersion Correction Calculations and Molecular Dynamics Simulation | خرم پور | Journal of Biomolecular Structure and Dynamics | 2019 |
| 73 | Molecular dynamics simulation study of Glycine tip-functionalisation of single-walled carbon nanotubes as emerging nanovectors for the delivery of anticancer drugs | Mahnaz Shahabi | MOLECULAR SIMULATION | 2019 |
| 74 | Assessment of dynamical properties of mercaptopurine on the peptide-based metal–organic framework in response to experience of external electrical fields: a molecular dynamics simulation | _ | Journal of Molecular Modeling | 2019 |
| 75 | Loading and release of anticancer drug from phosphorene as a template material with high efficient carrier: From vacuum to cell membrane | _ | Journal of Molecular Liquids | 2019 |
| 76 | Enhance the efficiency of 5-fluorouracil targeted delivery by using a prodrug approach as a novel strategy for prolonged circulation time and improved permeation | _ | International Journal of Pharmaceutics | 2019 |
| 77 | A density functional theory-based analysis of the structural, topological and electronic properties of Gemcitabine drug adsorption on the pyrrolidine functionalized single-walled carbon nanotube | , | Journal of Biomolecular Structure and Dynamics | 2019 |
| 78 | Theoretical investigation insights into the temperature triggered tegafur anticancer drug release from the surface of graphene oxide nanosheet | _ | Journal of Biomolecular Structure and Dynamics | 2019 |
| 79 | Predicting doxorubicin drug delivery by singlewalled carbon nanotube through cell membrane in the absence and presence of nicotine molecules: a molecular dynamics simulation study | _ | Journal of Biomolecular Structure and Dynamics | 2019 |
| 80 | Carbon and boron nanotubes as a template material for adsorption of 6-Thioguanine chemotherapeutic: a molecular dynamics and density functional approach | _ | Journal of Biomolecular Structure and Dynamics | 2019 |
