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Received September 19, 2022
Revised October 20, 2022
Accepted October 26, 2022
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Two-dimensional silicon carbide monolayer as a promising drug delivery vehicle for hydroxyurea anti-cancer drug

1Pharmacy College, Al-Farahidi University, Baghdad 10022 Iraq 2Department of Dentistry, Kut University College, Kut, Wasit, 52001, Iraq 3College of Pharmacy, The University of Mashreq, 10021 Baghdad, Iraq 4College of technical engineering, The Islamic University, Najaf, Iraq 5Medical Laboratory Techniques Department, Al-Turath University College, Iraq, Baghdad 6Department of Medical Laboratory, College of Health and Medical Technology, National University of Science and Technology, Thi-Qar, 64001, Iraq 7Department of Chemistry, College of Science, Mustansiriyah University, Baghdad, Iraq
Mustafa_kut88@yahoo.com
Korean Journal of Chemical Engineering, June 2023, 40(6), 1433-1439(7), 10.1007/s11814-022-1324-8
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Abstract

In nanobiotechnology, organic molecule-containing two-dimensional nano-structured materials are considered crucial for developing horizontal bio-inorganic nano-devices for pharmaceutical applications. We present a complete review of the application of silicon carbide monolayer (SiCML) for smart drug delivery of hydroxyurea (HU) through density functional theory computations. Also, interacting host-guest complexes with different approaching orientations, the charge transport, and the interaction strength were scrutinized. It was found that the application of HU together with SiCML was significantly effective for bio-functionalization with 35.86 kcal/mol interaction energy. The charge transfer from HU to the SiCML was confirmed by Hirshfeld method. The findings of the current study provide useful insights into research on the application of functionalized nano-biomaterials for drug delivery, nano-medicine, and other related fields

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