| Molecular dynamics simulation of novel diamino-functionalized hollow mesosilica spheres for adsorption of dyes from synthetic wastewater R Pelalak, R Soltani, Z Heidari, RE Malekshah, M Aallaei, A Marjani, ... Journal of Molecular Liquids 322, 114812, 2021 | 85 | 2021 |
| Developing a biopolymeric chitosan supported Schiff-base and Cu (II), Ni (II) and Zn (II) complexes and biological evaluation as pro-drug RE Malekshah, F Shakeri, A Khaleghian, M Salehi International journal of biological macromolecules 152, 846-861, 2020 | 70 | 2020 |
| Molecular dynamic simulations and quantum chemical calculations of adsorption process using amino-functionalized silica Y Cao, RE Malekshah, Z Heidari, R Pelalak, A Marjani, S Shirazian Journal of Molecular Liquids 330, 115544, 2021 | 58 | 2021 |
| Molecular modeling investigation on mechanism of cationic dyes removal from aqueous solutions by mesoporous materials Z Heidari, R Pelalak, RE Malekshah, M Pishnamazi, A Marjani, SM Sarkar, ... Journal of Molecular Liquids 329, 115485, 2021 | 55 | 2021 |
| A new insight into catalytic ozonation of sulfasalazine antibiotic by plasma-treated limonite nanostructures: Experimental, modeling and mechanism Z Heidari, R Pelalak, RE Malekshah, M Pishnamazi, M Rezakazemi, ... Chemical Engineering Journal 428, 131230, 2022 | 49 | 2022 |
| Molecular dynamics and quantum simulation of different cationic dyes removal from contaminated water using UiO-66 (Zr)-(COOH) 2 metal–organic framework L Feng, J Liu, NH Abu-Hamdeh, S Bezzina, RE Malekshah Journal of Molecular Liquids 349, 118085, 2022 | 47 | 2022 |
| Exploring ZnO/Montmorillonite photocatalysts for the removal of hazardous RhB Dye: A combined study using molecular dynamics simulations and experiments R Haounati, H Ighnih, RE Malekshah, S Alahiane, F Alakhras, E Alabbad, ... Materials Today Communications 35, 105915, 2023 | 46 | 2023 |
| Synthesis, molecular dynamics simulation and adsorption study of different pollutants on functionalized mesosilica R Pelalak, R Soltani, Z Heidari, RE Malekshah, M Aallaei, A Marjani, ... Scientific reports 11 (1), 1967, 2021 | 45 | 2021 |
| MOF as nanoscale drug delivery devices: Synthesis and recent progress in biomedical applications M Moharramnejad, A Ehsani, M Shahi, S Gharanli, H Saremi, ... Journal of Drug Delivery Science and Technology 81, 104285, 2023 | 43 | 2023 |
| Design and synthesis of heterocyclic azole based bioactive compounds: Molecular structures, quantum simulation, and mechanistic studies through docking as multi-target … J Haribabu, V Garisetti, RE Malekshah, S Srividya, D Gayathri, ... Journal of molecular structure 1250, 131782, 2022 | 42 | 2022 |
| Synthesis, characterization and crystal structures of two novel sulfa drug Schiff base ligands derived sulfonamide and molecular docking study M Salehi, M Kubicki, M Galini, M Jafari, RE Malekshah Journal of Molecular Structure 1180, 595-602, 2019 | 42 | 2019 |
| Z-Scheme g-C3N4/Fe3O4/Ag3PO4@ Sep magnetic nanocomposites as heterojunction photocatalysts for green malachite degradation and dynamic molecular studies R Haounati, H Ighnih, H Ouachtak, RE Malekshah, N Hafid, A Jada, ... Colloids and Surfaces A: Physicochemical and Engineering Aspects 671, 131509, 2023 | 34 | 2023 |
| Synthesis, characterization, biomedical application, molecular dynamic simulation and molecular docking of Schiff base complex of Cu (II) supported on Fe3O4/SiO2/APTS R Eshaghi Malekshah, B Fahimirad, A Khaleghian International journal of nanomedicine, 2583-2603, 2020 | 32 | 2020 |
| Zinc-based metal-organic frameworks: synthesis and recent progress in biomedical application M Moharramnejad, A Ehsani, S salmani, M shahi, RE Malekshah, ... Journal of Inorganic and Organometallic Polymers and Materials, 1-16, 2022 | 31 | 2022 |
| Effect of N-benzyl group in indole scaffold of thiosemicarbazones on the biological activity of their Pd (II) complexes: DFT, biomolecular interactions, in silico docking, ADME … N Balakrishnan, J Haribabu, RE Malekshah, S Swaminathan, ... Inorganica Chimica Acta 534, 120805, 2022 | 30 | 2022 |
| Synthesis and toxicity assessment of Fe3O4 NPs grafted by ∼ NH2-Schiff base as anticancer drug: modeling and proposed molecular mechanism through … R Eshaghi Malekshah, B Fahimirad, M Aallaei, A Khaleghian Drug Delivery 27 (1), 1201-1217, 2020 | 28 | 2020 |
| Crystal structure, molecular docking, and biological activity of the zinc complexes with 2-thenoyltrifluoroacetone and N-donor heterocyclic ligands RE Malekshah, M Salehi, M Kubicki, A Khaleghian Journal of Molecular Structure 1150, 155-165, 2017 | 28 | 2017 |
| New mononuclear copper(II) complexes from β-diketone and β-keto ester N-donor heterocyclic ligands: structure, bioactivity, and molecular simulation studies R Eshaghi Malekshah, M Salehi, M Kubicki, A Khaleghian Journal of Coordination Chemistry 71 (7), 952-968, 2018 | 25 | 2018 |
| Biological evaluation, proposed molecular mechanism through docking and molecular dynamic simulation of derivatives of chitosan RE Malekshah, F Shakeri, M Aallaei, M Hemati, A Khaleghian International Journal of Biological Macromolecules 166, 948-966, 2021 | 24 | 2021 |
| Synthesis, crystal structure, electrochemical behavior and docking molecular of poly-nuclear metal complexes of Schiff base ligand derived from 2-amino benzyl alcohol P Roozbahani, M Salehi, RE Malekshah, M Kubicki Inorganica Chimica Acta 496, 119022, 2019 | 23 | 2019 |
Mehdi SalehiProfessor of inorganic chemistry, Semnan UniversityVerified email at semnan.ac.ir
