| Covalent and non-covalent binding free energy calculations for peptidomimetic inhibitors of SARS-CoV-2 main protease E Awoonor-Williams, AAAA Abu-Saleh Physical Chemistry Chemical Physics 23 (11), 6746-6757, 2021 | 37 | 2021 |
| High-throughput virtual screening of drug databanks for potential inhibitors of SARS-CoV-2 spike glycoprotein IE Awad, AAAA Abu-Saleh, S Sharma, A Yadav, RA Poirier Journal of Biomolecular Structure and Dynamics 40 (5), 2099-2112, 2022 | 31 | 2022 |
| Discovery of potent inhibitors for SARS-CoV-2's main protease by ligand-based/structure-based virtual screening, MD simulations, and binding energy calculations AAAA Abu-Saleh, IE Awad, A Yadav, RA Poirier Physical Chemistry Chemical Physics 22 (40), 23099-23106, 2020 | 31 | 2020 |
| A computational study of the ozonolysis of phenanthrene M Almatarneh, E Al-Shamaileh, Z Ahmad, AA Abu-Saleh, I Elayan Acta Physica Polonica A 132 (3), 1149-1156, 2017 | 14 | 2017 |
| A computational mechanistic study of the deamination reaction of melamine MH Almatarneh, AAAA Abu‐Saleh, KM Uddin, RA Poirier, PL Warburton International Journal of Quantum Chemistry 117 (3), 180-189, 2017 | 12 | 2017 |
| Computational study for the second-stage cracking of the pyrolysis of ethylamine: decomposition of methanimine, ethenamine, and ethanimine MH Almatarneh, L Barhoumi, B Al-Tayyem, AAAA Abu-Saleh, M Marwa, ... Computational and Theoretical Chemistry 1075, 9-17, 2016 | 12 | 2016 |
| Synthesis, characterization, and DFT calculations of a new sulfamethoxazole schiff base and its metal complexes JI Al-Hawarin, AA Abu-Yamin, AAAA Abu-Saleh, IAM Saraireh, ... Materials 16 (14), 5160, 2023 | 11 | 2023 |
| Mechanistic and spectral investigation on the deamination of ammeline and ammelide MH Almatarneh, AAAA Abu-Saleh, IA Elayan Computational and Theoretical Chemistry 1117, 92-99, 2017 | 10 | 2017 |
| The gas‐phase ozonolysis reaction of methylbutenol: A mechanistic study MH Almatarneh, IA Elayan, AAAA Abu‐Saleh, M Altarawneh, PA Ariya International Journal of Quantum Chemistry 119 (10), e25888, 2019 | 9 | 2019 |
| Role of Asp190 in the phosphorylation of the antibiotic kanamycin catalyzed by the aminoglycoside phosphotransferase enzyme: a combined QM: QM and MD study AAAA Abu-Saleh, S Sharma, A Yadav, RA Poirier The Journal of Physical Chemistry B 124 (17), 3494-3504, 2020 | 7 | 2020 |
| Bimolecular reactions of carbenes: Proton transfer mechanism AAAA Abu-Saleh, MH Almatarneh, RA Poirier Chemical Physics Letters 698, 36-40, 2018 | 7 | 2018 |
| Accelerating the discovery of the beyond rule of five compounds that have high affinities toward SARS-CoV-2 spike RBD AAAA Abu-Saleh, A Yadav, RA Poirier Journal of Biomolecular Structure and Dynamics 41 (6), 2518-2527, 2023 | 3 | 2023 |
| Computational study of the dissociation reactions of secondary ozonide MH Almatarneh, SF Alrebei, M Altarawneh, Y Zhao, AAA Abu-Saleh Atmosphere 11 (1), 100, 2020 | 3 | 2020 |
| Computational Design of Potent Inhibitors for SARS-CoV-2’s Main Protease AAAA Abu-Saleh, I Awad, A Yadav, RA Poirier | 2 | 2020 |
| Molecular Insights into the Impact of Mutations on the Binding Affinity of Targeted Covalent Inhibitors of BTK E Awoonor-Williams, AAAA Abu-Saleh The Journal of Physical Chemistry B, 2024 | | 2024 |
| Computational Insights into the Thermophysical, Conformational and Electronic Properties of Diketopyrrolopyrrole and Isoindigo Based Semiconducting Polymers M Kosar, AAA Abu-Saleh, A Awada, S Vu, S Rondeau-Gagné, J Trant | | 2023 |
| Structural Mapping of the Base Stacks Containing Post-transcriptionally Modified Bases in RNA Z Ali, S Kaur, T Kukhta, AAAA Abu-Saleh, A Jhunjhunwala, A Mitra, ... The Journal of Physical Chemistry B 127 (27), 6049-6060, 2023 | | 2023 |
| Next Generation Phenethylamine-Based 5-HT2AR Agonists AAAA Abu-Saleh, UM Mirza, JF Trant US Patent App. 63/622,747, 2023 | | 2023 |
| Repurposing of Relatively Large Drugs for the Receptor Binding Domain of SARS-CoV-2 Spike Protein M Almatarneh, A Alqaisia, A Al-Shantia, AA Abu-Saleh | | 2022 |
| Design and Synthesis of Next Generation Tryptamine, Phenethylamine, and Related 5-HT2AR Agonists AAAA Abu-Saleh, MU Mirza, JF Trant, S Jonathan US Patent 63/434,994, 2022 | | 2022 |
Mansour H. AlmatarnehUniversity of Jordan, Chemistry DepartmentVerified email at ju.edu.jo
