DFT, molecular docking, antimicrobial activity, dye degradation, and oxygen evolution reaction of functionalized chitosan integrated eudragit-stannous selenide nanostructures

被引:0
作者
Fatima, Areej [1 ]
Naz, Misbah [1 ]
Haider, Ali [2 ]
Shahzadi, Iram [3 ]
Ul-Hamid, Anwar [4 ]
Ullah, Hameed [5 ]
Ali, Ghafar [6 ]
Moeen, Sawaira [7 ]
El-Bahy, Salah M. [8 ]
Ikram, Muhammad [7 ]
机构
[1] Univ Educ, Dept Chem, Div Sci & Technol, Lahore 54000, Punjab, Pakistan
[2] Muhammad Nawaz Shareef Univ Agr, Fac Vet & Anim Sci, Dept Clin Sci, Multan 66000, Punjab, Pakistan
[3] Univ Management & Technol, Sch Pharm, Lahore 54770, Pakistan
[4] King Fahd Univ Petr & Minerals, Core Res Facil, Dhahran 31261, Saudi Arabia
[5] Sao Paulo State Univ UNESP, Sch Sci, Dept Phys & Meteorol, BR-17033360 Bauru, SP, Brazil
[6] PINSTECH, Phys Div, Nanomat Res Grp NRG, Islamabad 44000, Pakistan
[7] Govt Coll Univ Lahore, Dept Phys, Solar Cell Applicat Res Lab, Lahore 54000, Punjab, Pakistan
[8] Taif Univ, Turabah Univ Coll, Dept Chem, POB 11099, Taif 21944, Saudi Arabia
关键词
Catalytic; Antimicrobial; Molecular docking; PHOTOCATALYTIC ACTIVITY; ANTIBACTERIAL ACTIVITY; SNO2; NANOPARTICLES; SNSE; PERFORMANCE; GROWTH; COPRECIPITATION; NANOCOMPOSITES; BEHAVIOR;
D O I
10.1016/j.surfin.2025.105907
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
A chemical coprecipitation route was employed to synthesize stannous selenide (SnSe) nanostructures (NSs) integrated with a fixed amount of eudragit L100 (Eud) and different concentrations of chitosan (CS). This study aimed to examine rhodamine B (RhB) reduction catalytically, oxygen evolution reaction (OER), and antimicrobial properties of CS/Eud-SnSe. Several characterization techniques were employed for morphological, structural, and optical analysis of prepared NSs. The optimized sample (4 % CS/Eud-SnSe) revealed considerable RhB reduction efficacy in an acidic medium as well as effective antibacterial activity against S. aureus. Molecular docking substantiated the suppressive role of CS/Eud-SnSe against DNA gyraseS. aureus,elaborating on their bactericidal effect. Moreover, 4 % CS/Eud-SnSe proved an efficient material for OER activity, depicting the lowest overpotential, Tafel slope, and Rctvalue.
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页数:12
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