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Biological evaluation and in silico molecular docking studies of Abies cilicica (Antoine & Kotschy) Carrière) resin
(ELSEVIER, 15.09.2023)
Abies cilicica (Antoine & Kotschy) Carrière) is an endemic species of industrial and medicinal importance. The resin obtained from this plant is effective for different diseases. The chemical content of the ethanol extract ...
Experimental and density functional theoretical analyses on degradation of acid orange 7 via UV irradiation and ultrasound enhanced by Fenton process
(05.04.2023)
In this study, Acid Orange 7 (AO7) removal from synthetic water by advanced oxidation processes was investigated. Within the scope of the study, individual and different integrated applications of Fenton reaction, ...
Equilibrium and DFT modeling studies for the biosorption of Safranin O dye from water samples using Bacillus subtilis biosorbent
(Elsevier, 2023)
Current study deals with the biosorption of Safranin O dye from water by using high potential Bacil-
lus subtilis biosorbent material. The presence of functional groups and surface morphology of biosor-
bent was analyzed ...
Incorporation of graphene oxide to metal-free phthalocyanine through hydrogen bonding for optoelectronic applications: An experimental and computational study
(WILEY, 2023)
This paper focuses on incorporation of graphene oxide (GO) to metal-free phthalocyanine (MPc) through only hydrogen bonding and π-π stacking. Briefly, Pc-GO composites at various concentrations were prepared by selfassembly ...
Biosorption of lead ions (Pb2+) from water samples using dried Lemna minor biomass: experimental and density functional theory studies
(Springer, 24.02.2023)
Lemna minor biomass, a novel source of biosorbent, was found to exhibit high adsorption potential over a wide range of concentrations of Pb2+. The biosorbent was characterized by Fourier transform infrared (FTIR) ...
Density Functional Theory Computations and Experimental Analyses to Highlight the Degradation of Reactive Black 5 Dye
(08.08.2023)
The oxidative degradation of Reactive Black 5 (RB5) in aqueous solution was investigated using Fenton (FP), photo Fenton (P-FP), sono Fenton (S-FP), and sono photo Fenton (S-P-FP) processes. Degradation experiments showed ...
Biosorption of lead ions (Pb2+) from water samples using dried Lemna minor biomass: experimental and density functional theory studies
(Springer, 24.02.2023)
Lemna minor biomass, a novel source of biosorbent, was found to exhibit high adsorption potential over a wide range of concentrations of Pb2+. The biosorbent was characterized by Fourier transform infrared (FTIR) ...
Analysis of boronic acids containing amino ferrocene by DFT approach and in silico studies
(Elsevier, 2023)
The synthesized (2)-(6) complexes and (2′)-(6′) hypothetical complexes formed by attached boranic acid esters were optimized at the DFT-B3LYP/GEN level. The structural and spectroscopic properties (IR, 1HNMR , 13CNMR ) of ...
Equilibrium and Computational Chemical Modelling Studies for the Removal of Methyl Orange and Methyl Red Dyes from Water Using Modified Silica Resin
(Taylor & Francis, 2023)
This study describes the removal of methyl orange (MO) and methyl red (MR) dyes from water samples using morpholinomethylcalix[4]arene immobilised silica (MIS) resin. The silica surface has been modified by p-morpholinom ...
Green synthesis of reduced graphene oxide and their use on column adsorption of phenol from olive mill wastewater
(2023)
A novel reduced graphene oxide (RGO) synthesis using Verbena officinalis as a green, reducing agent was outreaching.
RGO was encapsulated in sodium alginate (SA) by cross-linking (SA-RGO beads). SA-RGO beads
have been ...