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Browsing by Author "Jaffar, Kinza"

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A DFT approach towards therapeutic potential of phosphorene as a novel carrier for the delivery of felodipine (cardiovascular drug)

Jaffar, Kinza; Riaz, Saima; Afzal, Qaba Qusain; Perveen, Mehvish; Tahir, Muhammad Asif; Nazir, Sidra; Iqbal, Javed; Alrowaili, Z. A.; ben Ahmed, Samia (2022)

In this study, Density Functional Theory (DFT) calculations were performed to evaluate the efficiency of phosphorene as a carrier for delivery of felodipine. The felodipine drug, phosphorene carrier, and felodipinephosphorene ...
DFT study of 2D graphitic carbon nitride based preferential targeted delivery of levosimendan, a cardiovascular drug

Afzal, Qaba Qusain; Rafique, Javeria; Jaffar, Kinza; Perveen, Mehvish; Iqbal, Javed; Al-Buriahi, M. S.; Alomairy, Sultan; Alrowaili, Z. A.; Somaily, H. H. (2022)

2D nanocarriers particularly graphitic carbon nitride (g-C3N4) have shown its momentum in nanomedicine to augment the efficacy and safety of pharmaceutical drugs owing to its excellent compatibility and nontoxic nature. ...
Quantum chemical study of end-capped acceptor and bridge on triphenyl diamine based molecules to enhance the optoelectronic properties of organic solar cells

Jaffar, Kinza; Elqahtani, Zainab Mufarreh; Afzal, Qaba Qusain; Ans, Muhammad; Riaz, Saima; Tahir, Muhammad Asif; Iqbal, Javed; Mahmoud, Zakaria M. M.; Alrowail, Z. A. (2022)

This research project focuses on quantum chemical study of triphenyl diamine based molecules and DFT analysis of reference XSln847 and nine designed molecules to boost the efficiencies of organic solar cells and to make ...