| Ensemble learning from ensemble docking: Revisiting the optimum ensemble size problem S Mohammadi, Z Narimani, M Ashouri, R Firouzi, MH Karimi‐Jafari Scientific reports 12 (1), 410, 2022 | 21 | 2022 |
| Coping with the anisotropy in the analytical representation of an ab initio potential energy surface for the Cl 2 dimer MH Karimi-Jafari, M Ashouri, A Yeganeh-Jabri Physical Chemistry Chemical Physics 11 (27), 5561-5568, 2009 | 13 | 2009 |
| Structural insights into the substrate‐binding site of main protease for the structure‐based COVID‐19 drug discovery R Firouzi, M Ashouri, MH Karimi‐Jafari Proteins: Structure, Function, and Bioinformatics 90 (5), 1090-1101, 2022 | 10 | 2022 |
| Computational evidence of new putative allosteric sites in the acetylcholinesterase receptor B Moghadam, M Ashouri, H Roohi, MH Karimi-Jafari Journal of Molecular Graphics and Modelling 107, 107981, 2021 | 9 | 2021 |
| Quantifying the anisotropy of intermolecular potential energy surfaces: a critical assessment of available N 2–N 2 potentials MH Karimi-Jafari, M Ashouri Physical Chemistry Chemical Physics 13 (20), 9887-9894, 2011 | 9 | 2011 |
| Investigation of adsorption mechanism of Fe, Cu, and Zn ions in extraction and preconcentration process on synthesized graphene oxide using an indole derivative MR Pourjavid, MH Hosseini, M Rezaee, M Ashouri Structural Chemistry 29, 615-624, 2018 | 6 | 2018 |
| Hydrogen bonding motifs in a hydroxy-bisphosphonate moiety: revisiting the problem of hydrogen bond identification M Ashouri, A Maghari, MH Karimi-Jafari Physical Chemistry Chemical Physics 17 (20), 13290-13300, 2015 | 6 | 2015 |
| Identification of potential anti‐COVID‐19 drug leads from medicinal plants through virtual high‐throughput screening R Firouzi, M Ashouri ChemistrySelect 8 (7), e202203865, 2023 | 4 | 2023 |
| Identification of Catechins’ Binding Sites in Monomeric Aβ42 through Ensemble Docking and MD Simulations R Firouzi, S Sowlati-Hashjin, C Chávez-García, M Ashouri, ... International Journal of Molecular Sciences 24 (9), 8161, 2023 | 3 | 2023 |
| Identification of Catechins Binding Pockets in Monomeric Aβ42 Through Ensemble Docking and MD Simulations R Firouzi, S Sowlati-Hashjin, C Chávez-García, M Ashouri, ... BioRxiv, 2022.02. 09.479729, 2022 | 2 | 2022 |
| A database of chemical compositions of Persian medicinal herbs MH Karimi-Jafari, R Firouzi, M Ashouri, A Poursoleiman | 1 | 2022 |
| Micro-solvation of a bisphosphonate group: an ab initio and effective fragment potential analysis M Ashouri, MH Karimi-Jafari, A Maghari Structural Chemistry 28, 1201-1210, 2017 | 1 | 2017 |
| Virtual Screening and binding mode analysis of selected FDA approved drugs against PLpro target: An effort to identify therapeutics to combat COVID-19 M Ashouri, R Firouzi | | 2023 |
| APPLICATION OF MARKOV STATE MODEL TO DESCRIBE THE DYNAMICAL BEHAVIOR OF THE IOWA MUTATION IN AMYLOID BETA M AGHAYARI, M ASHOURI, R FIROUZI | | 2016 |
| A REVIEW OF THE EXTENT OF CULTURAL FULFILLMENT OBJECTIVES IN IRAN'S FIRST AND SECOND DEVELOPMENT PLANS M AGHAYARI, M ASHOURI DANESHVAR MEDICINE 10 (42), 41-52, 2003 | | 2003 |
| 19th Iranian Physical Chemistry Conference M Aghayari, M Ashouri, R Firouzi | | |
| Supplementary Information for: Hydrogen Bonding Motifs in a Hydroxy-Bisphosphonate Moiety: Revisiting the Problem of Hydrogen Bond Identification M Ashouri, A Maghari, MH Karimi-Jafari | | |
