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The purpose of this paper is to discuss the use of topological indices (TIs) to anticipate the physical and biological aspects of innovative drugs used in the treatment of Alzheimer's disease. Degree-based topological indices are generated using edge partitioning to assess the drugs Tacrine, Donepezil, Ravistigmine, Butein, Licochalcone-A and Flavokqwain-A. Furthermore, using linear regression, a quantitative structure–property relationship (QSPR) model is developed to predict the characteristics such as boiling point (BP), flash point (FP), molar volume (MV), molecular weight, complexity and polarizability. The findings show that topological indices have the potential to be used as a tool for drugs discovery and design in the field of Alzheimer's disease treatment. [ABSTRACT FROM AUTHOR]

Water pollution is a grave risk to mankind. Water pollutants including organic toxins, dyes effluents, and heavy metals have posed great stress on water quality in recent years. This has necessitated the search for an affordable, eco-friendly, inexpensive, stable, and effective strategy for wastewater remediation. In this work, a pollyoxometallate K6[H2AlBW11O40].9H2O (KAB) was impregnated on kaolin clay to synthesize a clay-based nanocomposite KAB-K which was then evaluated for adsorptive removal of brilliant green dye (BG) from wastewater. The prepared composite was characterized by different techniques such as FTIR, SEM, and EDX analysis. The characterization results indicated the fine distribution of KAB on kaolin's surface. The adsorption studies of BG involved evaluation of optimum parameters such as time contact (30 min), quantity of adsorbent (20 mg), pH (5), temperature (40 °C), and agitation speed (125 rpm). 99.5% of BG was removed by KAB-K within 30 min. The assessment of kinetic data was performed via Langmuir, Freundlich, and Temkin models. The experimental data was found to be in good agreement with the Langmuir model (R2 > 0.9965) as compared to other models. Qmax value of KAB-K (144.92 ± 0.005 mg/g) was much higher than simple kaolin (33.22 ± 0.01 mg/g). The applicability of the pseudo-second-order kinetic model suggested that the process was predominately chemisorption. KAB-K was easier to recycle and efficiently removed up to 68.7% dye in 3 subsequent cycles. Thus rapid adsorption rate, high adsorption capacity, efficient recovery, and reusability of KAB-K endorses that the synthesized composite is an effective adsorbent for wastewater pollutants. [ABSTRACT FROM AUTHOR]

The photocatalytic degradation of dyes (alizarin red S, amaranth, congo red, and rhodamine B) present in wastewater was performed with UV lamp. The catalysts employed for this investigation were ZnO, TiO2, and SnO2. The kinetic studies of dyes degradation followed first order reaction. ZnO was found to be most efficient photo-catalyst for degrading these dyes. The optimal result for alizarin red S was k = 0.2118 min−1, t1/2 = 3.27 min, and R2 = 0.7998, for amaranth was k = 0.146 min−1, t1/2 = 4.74 min, and R2 = 0.8348, for congo red was k = 0.2452 min−1, t1/2 = 2.8 min, and R2 = 0.8382, and for rhodamine B was k = 0.1915 min−1, t1/2 = 3.6 min, and R2 = 0.76. [ABSTRACT FROM AUTHOR]