۸۱ | Two dimensional porous frameworks of graphyne family as therapeutic delivery vehicles for Idarubicin biomolecule in silico: Density functional theory and molecular dynamics simulation | حیدر رئیسی,مهناز شهابی چشمه موسی | Journal of Molecular Liquids | 2020 |
۸۲ | Probing the adsorption and release mechanisms of cytarabine anticancer drug on/from dopamine functionalized graphene oxide as a highly efficient drug delivery system | فرزانه فرزاد,نفیسه رحمانی مقدم,حیدر رئیسی,مریم زابلی | Journal of Molecular Liquids | 2020 |
۸۳ | Probing the adsorption and release mechanisms of cytarabine anticancer drug on/from dopamine functionalized graphene oxide as a highly efficient drug delivery system | فرزانه فرزاد,مریم زابلی,نفیسه رحمانی مقدم,حیدر رئیسی | Journal of Molecular Liquids | 2020 |
۸۴ | Molecular mechanism of drug transport and release through zeolitic imidazole framework nanospheres for versatile drug delivery applications | _ | Journal of Molecular Liquids | 2023 |
۸۵ | The state of art in the prediction of efficiency and modeling of the processes of Benzene removal from water environment | ameneh zaboli arbab din mohamad,Hassan Hashemzadeh | Journal of Molecular Liquids | 2023 |
۸۶ | Efficient immobilization of horseradish peroxidase enzyme on transition metal carbides | seyede leila Razavi Khoosfi | Journal of Molecular Liquids | 2023 |
۸۷ | The functionalization of carbon nanotubes to enhance the efficacy of the anticancer drug paclitaxel a molecular dynamics simulation study | _ | Journal of Molecular Modeling | 2017 |
۸۸ | Investigation of graphene-based nanomaterial as nanocarrier for adsorption of paclitaxel anticancer drug a molecular dynamics simulation study | _ | Journal of Molecular Modeling | 2017 |
۸۹ | 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 |
۹۰ | Using molecular dynamics simulation to explore the binding of the three potent anticancer drugs sorafenib, streptozotocin, and sunitinib to functionalized carbon nanotubes | _ | Journal of Molecular Modeling | 2019 |
۹۱ | Ab initio and DFT computational studies on molecular conformations and strength of the intramolecular hydrogen bond in different conformers of 3-amino-2-iminomethyl acryl aldehyde | Nowroozi A.R | Journal of Molecular Structure-theochem | 2011 |
۹۲ | O-H S intramolecular hydrogen bond in thiomalonaldehyde derivatives A quantum chemical study | Nowroozi A.R, Roohi H,Hajiabadi H,Khalilinia E, Birgan M.N | Journal of Molecular Structure-theochem | 2011 |
۹۳ | The effects of substituitions on structure electron density resonance and intramolecular hydrogen bonding strength in a mercapto-propenethial | ,,, | Journal of Molecular Structure-theochem | 2010 |
۹۴ | Investigation of the Pristine and Functionalized Carbon Nanotubes as a Delivery System for the Anticancer Drug Dacarbazine: Drug Encapsulation | حیدر رئیسی,حلیمه میرسالاری,افسانه مالکی,عظیم سلطان ابادی | Journal of Pharmaceutical Sciences | 2021 |
۹۵ | Covalent organic framework as smart and high efficient carrier for anticancer drug delivery a DFT calculations and molecular dynamics simulation study | _ | Journal of Physics D: Applied Physics | 2018 |
۹۶ | A DFT investigation of axial N-donor ligands effects on the high valent manganese-oxo meso-tetraphenyl porphyrin | Maasoumeh Jafarpour | Journal of Porphyrins and Phthalocyanines | 2015 |
۹۷ | Stereoelectronic effects of porphyrin ligand on the oxygen transfer efficiency of high valent manganese-oxo porphyrin species A DFT study | Maasoumeh Jafarpour | Journal of Porphyrins and Phthalocyanines | 2015 |
۹۸ | Significant hydrogen-bonding effect on the reactivity of high-valent manganese(V) oxo porphyrins in C H bond activation A DFT study | Maasoumeh Jafarpour | Journal of Porphyrins and Phthalocyanines | 2015 |
۹۹ | On the pseudocapacitive behavior of nanostructured molybdenum oxide | Hossein Farsi, | JOURNAL OF SOLID STATE ELECTROCHEMISTRY | 2010 |
۱۰۰ | The pH effects on the capacitive behavior of nanostructured molybdenum oxide | Hossein Farsi,gobal ferydoon | JOURNAL OF SOLID STATE ELECTROCHEMISTRY | 2010 |