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H R Abd El-Mageed

Explore the profile of H R Abd El-Mageed including associated specialties, affiliations and a list of published articles. Areas
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Articles 20
Citations 137
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Recent Articles
1.
Ahmed Atto Al-Shuaeeb R, Abd El-Mageed H, Ahmed S, Mohamed H, Hamza Z, Rafi M, et al.
J Biomol Struct Dyn . 2023 May; 41(23):14484-14496. PMID: 37184133
Microtubule affinity regulating kinase (MARK4) has been proposed as a potential therapeutic target for diabetes, cancer, and neurological diseases. We used a variety of computational studies techniques to examine the...
2.
Almalki A, Belal A, Farghali A, Mahmoud R, Mustafa F, Abd El-Mageed H
J Biomol Struct Dyn . 2023 Mar; 42(1):231-243. PMID: 36995176
For the first time, the interaction of the Poly lactic-co-glycolic acid (PLGA) and Chitosan (CH) with Zirconium dioxide (ZrO) nanotube was studied using density functional theory (DFT). The binding energies...
3.
Ahmed Atto Al-Shuaeeb R, Abd El-Mageed H, Ahmed S, Mohamed H, Hamza Z, Rafi M, et al.
J Biomol Struct Dyn . 2023 Jan; 41(21):11437-11449. PMID: 36591698
Pandemic new severe acute respiratory syndrome coronavirus (SARS-CoV-2) virus has increased throughout the world. There is no effective treatment against this virus until now. Since its appearance in Wuhan, China...
4.
Mohamed F, Shaban M, Zaki S, Abd-Elsamie M, Sayed R, Zayed M, et al.
Sci Rep . 2022 Oct; 12(1):18031. PMID: 36302936
The introduction of activated carbon/natural zeolite (AC/NZ) as an efficient and reliable nanoadsorbent for enhancing methylene blue (MB) dye adsorption. By calcining sugarcane waste at various temperatures between 500 and...
5.
Ibrahim M, Shehata M, Soliman M, Moustafa M, Abd El-Mageed H, Moussa N
Phys Chem Chem Phys . 2022 Jan; 24(5):3386-3399. PMID: 35072679
Chalcogen⋯chalcogen interactions were investigated within four types of like⋯like and unlike YCY⋯YCY complexes (where Y = O, S, or Se). A plethora of quantum mechanical calculations, including molecular electrostatic potential...
6.
Ahmed Atto Al-Shuaeeb R, Yassin A, Ibrahim M, Abd El-Mageed H, Ghandour M, Khalil M
J Biomol Struct Dyn . 2022 Jan; 41(5):1553-1560. PMID: 34974817
methods such as molecular docking and molecular dynamic (MD) simulations have significant interest due to their ability to identify the protein-ligand interactions at the atomic level. In this work, different...
7.
Ibrahim M, Mohamed Y, Abd Elhafez H, Shehata M, Soliman M, Ahmed M, et al.
J Mol Graph Model . 2021 Dec; 111:108097. PMID: 34890896
For the first time, the potentiality of the sp-hybridized group IV-VII radical (R)-containing molecules to participate in R-hole interactions was comparatively assessed using SiFPOF, SOF, and ClO models in the...
8.
Ibrahim M, Kamel A, Soliman M, Moustafa M, Abd El-Mageed H, Taha F, et al.
ACS Omega . 2021 Oct; 6(39):25476-25485. PMID: 34632205
A quantum chemical study was accomplished on the σ-hole interactions of the barely explored group IV elements, for the first time, in the absence and presence of the positively and...
9.
Soliman N, Moustafa A, Abd El-Mageed H, Abdel-Gawad O, Elkady E, Ahmed S, et al.
Sci Rep . 2021 Aug; 11(1):17034. PMID: 34404897
No abstract available.
10.
Abd El-Mageed H, Abbas H
J Biomol Struct Dyn . 2021 Aug; 40(19):9464-9483. PMID: 34380372
Lately, drug delivery systems established on nanostructures have become the most proficient to be studied. There are different studies suggested that the BN nanoclusters can be used as drug carriers...