A5081231082- Inorganic and Organometallic Chemistry
- ZnO doping and properties
- Gas Sensing Nanomaterials and Sensors
- Synthesis and biological activity
- Advanced Chemical Physics Studies
- Synthesis and Characterization of Heterocyclic Compounds
- Computational Drug Discovery Methods
University of Calabar
2022-2024
Abstract Gas sensors exhibit significant potential due to their widespread use in various applications, such as food packaging, indoor air quality assessment, and real-time monitoring of man-made gas emissions mitigate global warming. The utilization nanostructured materials for sensor adsorbent surfaces has seen remarkable growth over time, though substantial efforts are still needed develop more efficient adsorbents. Consequently, this study investigates the viability metal-doped quantum...
Advanced computational tools allowed to study a pure commercial sample of dichlorodiphenyltrichloroethane (DDT) prepared in liquid phase KBr pellets and characterized using FT-IR GC-MS followed by the application DDT for molecular docking against human estrogen receptor alpha. The compound was modelled GaussView software. Using Veda 04 program, theoretical vibrational energy distributions experimental frequencies were compared. Interestingly, C1 C2�possess highest atomic charge density...
Advanced computational tools allowed to study a pure commercial sample of dichlorodiphenyltrichloroethane (DDT) prepared in liquid phase KBr pellets and characterized using FT-IR GC-MS followed by the application DDT for molecular docking against human estrogen receptor alpha. The compound was modelled GaussView software. Using Veda 04 program, theoretical vibrational energy distributions experimental frequencies were compared. Interestingly, C1 C2�possess highest atomic charge density...