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Al-shimaa S. M. Rady
Al-shimaa S. M. Rady
Computational Chemistry Laboratory, Chemistry Department, Faculty of Science, Minia University
在 compchem.net 的电子邮件经过验证
标题
引用次数
引用次数
年份
±π‐Hole Interactions: A Comparative Investigation Based on Boron‐Containing Molecules
MAA Ibrahim, ASM Rady, JH Al‐Fahemi, EMZ Telb, SA Ahmed, ...
ChemistrySelect 5 (42), 13223-13231, 2020
172020
Adsorption of chlormethine anti-cancer drug on pure and aluminum-doped boron nitride nanocarriers: A comparative DFT study
MAA Ibrahim, ASM Rady, AMA Mandarawe, LA Mohamed, AM Shawky, ...
Pharmaceuticals 15 (10), 1181, 2022
112022
π-Hole interactions of group III–VI elements with π-systems and Lewis bases: A comparative study
MAA Ibrahim, ASM Rady, MES Soliman, MF Moustafa, HRA El-Mageed, ...
Structural Chemistry, 1-13, 2022
112022
Investigation of aluminum nitride nanocarrier for drug delivery process of Favipiravir: A DFT study
MAA Ibrahim, ASM Rady, NAM Moussa, MN Ahmed, PA Sidhom, ...
Journal of Molecular Liquids 372, 121209, 2023
102023
Adsorption of Molnupiravir anti-COVID-19 drug over B12N12 and Al12N12 nanocarriers: a DFT study
MAA Ibrahim, ASM Rady, LA Mohamed, AM Shawky, THA Hasanin, ...
Journal of Biomolecular Structure and Dynamics 41 (22), 12923-12937, 2023
62023
σ‐Hole Interactions of Tetrahedral Group IV–VIII Lewis Acid Centers with Lewis Bases: A Comparative Study
MAA Ibrahim, YAM Mohamed, HAA Abuelliel, ASM Rady, MES Soliman, ...
ChemistrySelect 6 (43), 11856-11864, 2021
62021
Elucidating the adsorption of 2-Mercaptopyridine drug on the aluminum phosphide (Al12P12) nanocage: A DFT study
ASM Rady, NAM Moussa, LA Mohamed, PA Sidhom, SRM Sayed, ...
Heliyon 9 (8), 2023
42023
Effects of Lewis basicity and acidity on σ-hole interactions in carbon-bearing complexes: a comparative ab initio study
MAA Ibrahim, MNI Shehata, ASM Rady, HAA Abuelliel, HSM Abd Elhafez, ...
International Journal of Molecular Sciences 23 (21), 13023, 2022
32022
σ-Hole and LP-Hole Interactions of Pnicogen··· Pnicogen Homodimers under the External Electric Field Effect: A Quantum Mechanical Study
MAA Ibrahim, NAM Moussa, SMA Saad, MN Ahmed, AM Shawky, ...
ACS omega 7 (13), 11264-11275, 2022
32022
sSM
MAA Ibrahim, A Rady
Mandarawe, AMA, 0
1
Beryllium Oxide (Be12O12) as a Nanocarrier for Cisplatin Anticancer Drug and Some of Its Analogs: A DFT Investigation
MAA Ibrahim, AHH Mahmoud, ASM Rady, PA Sidhom, SRM Sayed, ...
Journal of Molecular Structure, 138995, 2024
2024
A Comparative DFT Investigation of the Adsorption of Temozolomide Anticancer Drug over Beryllium Oxide and Boron Nitride Nanocarriers
MAA Ibrahim, ASSM Rady, PA Sidhom, SRM Sayed, KE Ibrahim, ...
ACS omega, 2024
2024
σ-Hole, lone-pair-hole, and π-hole site-based interactions in aerogen-comprising complexes: a comparative study
MAA Ibrahim, HAA Abuelliel, NAM Moussa, ASM Rady, SRM Sayed, ...
RSC advances 14 (31), 22408-22417, 2024
2024
sigma-Hole and LP-Hole Interactions of Pnicogen center dot center dot center dot Pnicogen Homodimers under the External Electric Field Effect: A Quantum Mechanical Study
MAA Ibrahim, NAM Moussa, S Saad, MN Ahmed, AM Shawky, ...
ACS OMEGA 7 (13), 11264-11275, 2022
2022
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