11 Papers
Sidra Khan is an academic researcher from COMSATS Institute of Information Technology. The author has contributed to research in topics: Chemistry & Thiophosgene. The author has an hindex of 7, co-authored 9 publications.
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Papers
Adsorption behaviour of chronic blistering agents on graphdiyne; excellent correlation among SAPT, reduced density gradient (RDG) and QTAIM analyses
TL;DR: In this paper, the adsorption of nitrogen (NM) and sulphur mustard (SM) blistering agents on graphdiyne (GDY) sheet was analyzed by using density functional theory calculations.
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Machine learning-assisted signature and heuristic-based detection of malwares in Android devices
Zahoor-ur Rehman,Sidra Khan,Khan Muhammad,Jong Weon Lee,Zhihan Lv,Sung Wook Baik,Peer Azmat Shah,Khalid Mahmood Awan,Irfan Mehmood +8 more
TL;DR: An efficient hybrid framework is presented for detection of malware in Android Apps that considers both signature and heuristic-based analysis for Android Apps, and results show improved accuracy in malware detection.
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High selectivity of cyclic tetrapyrrole over tetrafuran and tetrathiophene toward toxic chemicals; A first-principles study
TL;DR: In this article, density functional theory calculations are performed to study the interaction behavior of tetracyclic oligomers such as tetrapyrrole (4CP), tetrafuran (4CF) and tetrathiophene (4CT) for the detection of harmful gases like, phosgene, thiophosgenes and formaldehyde.
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First-principles study for exploring the adsorption behavior of G-series nerve agents on graphdyine surface
Sidra Khan,Muhammad Yar,Naveen Kosar,Khurshid Ayub,Muhammad Nadeem Arshad,Muhammad Nauman Zahid,Tariq Mahmood +6 more
TL;DR: In this article, the sensing results reveal the physisorption of analytes at the triangular portion of graphdiyne surface, showing that GA shows the highest interaction energy of −16.31 kcal/mol.
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Effective adsorption of A-series chemical warfare agents on graphdiyne nanoflake: a DFT study
TL;DR: In this article, the utility of graphdiyne (GDY) nanoflake is studied theoretically as an electrochemical sensor material for the hazardous CWAs including A-230, A-232, and A-234.
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