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Al-Shimaa S M Rady

5PUBLICATIONS
10CO-AUTHORS
Biologically active moleculesNanoelectronicsNanomedicineCondensed matter modelling and density functional theoryNanomaterials
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Journal

Publications (5)

Sort by Publication Date:
|Sep 12, 2025
MD-enhanced DFT investigation of β-cyclodextrin as drug delivery system for Ampyra drug.

Al-Shimaa S M Rady, Peter A Sidhom, Lamiaa A Mohamed

|Nov 22, 2024
A DFT investigation on the potential of beryllium oxide (Be12O12) as a nanocarrier for nucleobases.

Mahmoud A A Ibrahim, Maggie N S Hanna, Al-Shimaa S M Rady

|Jan 23, 2023
Adsorption of Molnupiravir anti-COVID-19 drug over B<sub>12</sub>N<sub>12</sub> and Al<sub>12</sub>N<sub>12</sub> nanocarriers: a DFT study.

Mahmoud A A Ibrahim, Al-Shimaa S M Rady, Lamiaa A Mohamed

|Nov 11, 2022
Effects of Lewis Basicity and Acidity on σ-Hole Interactions in Carbon-Bearing Complexes: A Comparative Ab Initio Study.

Mahmoud A A Ibrahim, Mohammed N I Shehata, Al-Shimaa S M Rady

|Oct 27, 2022
Adsorption of Chlormethine Anti-Cancer Drug on Pure and Aluminum-Doped Boron Nitride Nanocarriers: A Comparative DFT Study.

Mahmoud A A Ibrahim, Al-Shimaa S M Rady, Asmaa M A Mandarawe

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Frequent Collaborators

5 joint publications

Mahmoud A A Ibrahim

3 joint publications

Nayra A M Moussa

2 joint publications

Lamiaa A Mohamed

2 joint publications

Ahmed M Shawky

2 joint publications

Peter A Sidhom

1 joint publications

Mohammed N I Shehata

1 joint publications

Mohamed A El-Tayeb

1 joint publications

Tamer Shoeib

1 joint publications

Khalid Elfaki Ibrahim

1 joint publications

Shahzeb Khan

Frequent Collaborators

5 joint publications

Mahmoud A A Ibrahim

3 joint publications

Nayra A M Moussa

2 joint publications

Lamiaa A Mohamed

2 joint publications

Ahmed M Shawky

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