Applications of macrocycle-based solid-state host–guest chemistry

H Zhu, L Chen, B Sun, M Wang, H Li… - Nature Reviews …, 2023 - nature.com
Macrocyclic molecules have been used in various fields owing to their guest binding
properties. Macrocycle-based host–guest chemistry in solution can allow for precise control …

Triggered and controlled release of active gaseous/volatile compounds for active packaging applications of agri‐food products: A review

A Zaitoon, X Luo, LT Lim - … Reviews in Food Science and Food …, 2022 - Wiley Online Library
Gaseous and volatile active compounds are versatile to enhance safety and preserve quality
of agri‐food products during storage and distribution. However, the use of these compounds …

Interaction of imidazolium based ionic liquid electrolytes with carbon nitride electrodes in supercapacitors; a step forward for understanding electrode–electrolyte …

M Aetizaz, S Sarfaraz, K Ayub - Journal of Molecular Liquids, 2023 - Elsevier
Ionic liquids (ILs) are considered as an emerging class of electrolytes finding their
applications in energy storage devices due to wide electrochemical windows …

DFT investigation of adsorption of nitro-explosives over C2N surface: Highly selective towards trinitro benzene

S Sarfaraz, M Yar, AA Khan, R Ahmad… - Journal of Molecular …, 2022 - Elsevier
Sensitive and rapid detection of nitro-explosives is vital to ensure military and homeland
security. Therefore, we have carried out DFT calculations to explore the selectivity and …

Nitrogenated holey graphene (C2N) surface as highly selective electrochemical sensor for ammonia

M Yar, MA Hashmi, K Ayub - Journal of Molecular Liquids, 2019 - Elsevier
Electron rich nitrogenated holey graphene C 2 Nh 2 D material with controlled pore size is
explored as an efficient sensor and adsorption material for toxic and warfare agents (NH 3 …

Computational investigation of a covalent triazine framework (CTF-0) as an efficient electrochemical sensor

S Sarfaraz, M Yar, M Ans, MA Gilani, R Ludwig… - RSC …, 2022 - pubs.rsc.org
In the current study, a covalent triazine framework (CTF-0) was evaluated as an
electrochemical sensor against industrial pollutants ie, O3, NO, SO2, SO3, and CO2. The …

Covalent Organic Framework (C6N6) as a Drug Delivery Platform for Fluorouracil to Treat Cancerous Cells: A DFT Study

MA Alkhalifah, M Yar, I Bayach, NS Sheikh, K Ayub - Materials, 2022 - mdpi.com
Continuous studies are being carried out to explore new methods and carrier surfaces for
target drug delivery. Herein, we report the covalent triazine framework C6N6 as a drug …

Supramolecular adsorbents in extraction and separation techniques-A review

J Ma, Y Zhang, B Zhao, Q Jia - Analytica Chimica Acta, 2020 - Elsevier
Sample preparation procedure before the detection step is of great importance for
successful realization of an analytical method. The extraction and preconcentration …

Carbon nitride 2-D surface as a highly selective electrochemical sensor for V-series nerve agents

M Yar, MA Hashmi, A Khan, K Ayub - Journal of Molecular Liquids, 2020 - Elsevier
Herein, carbon nitride 2-D surface (C 2 N) was studied as an electrochemical sensor for
chemical warfare agents (CWA; A-230, A-232, A-234, and VR). The deep insight of …

Unravelling the nature of binding of cubane and substituted cubanes within cucurbiturils: A DFT and NCI study

NS Venkataramanan, A Suvitha, Y Kawazoe - Journal of Molecular Liquids, 2018 - Elsevier
The nature of interactions between the neutral, charged and substituted cubane, within
cucurbituril host were analyzed employing the dispersion corrected density functional …