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Quantum chemical and molecular dynamic simulation studies for the identification of the extracted cinnamon essential oil constituent responsible for copper corrosion inhibition in acidified 3.0 wt% NaCl medium
(Elsevier, Şubat 2021)
The influence of the extracted cinnamon essential oil (CiO) on the copper corrosion resistance in acidified 3.0 wt% NaCl (pH = 2) medium was investigated by using electrochemical measurements and Scanning Electron Microscopy ...
Biologically active phthalocyanine metal complexes: Preparation, evaluation of α-glycosidase and anticholinesterase enzyme inhibition activities, and molecular docking studies
(Wiley, mart 2021)
In this study, preparation, as well as investigation of α-glycosidase and cholinesterase (ChE) enzyme inhibition activities of furan-2-ylmethoxy-substituted compounds 1–7, are reported. Peripherally, tetra-substituted ...
Synthesis and competitive 7 Li NMR studies of two morpholine-based ligands
(Elsevier, 2021)
7 Li NMR spectroscopy was used to investigation the stability, stoichiometry and thermodynamic infor- mation of a Li + complex with one known, N1-(2-morpholinoethyl)-N1-((pyridine-2-yl)methyl)propane- 1,3-diamine (A 1 ) ...
Experimental and in silico studies of dichloro- tetrakis (1H-pyrazole)-cobalt(II): Structural description, photoluminescent behavior and molecular docking
(2021)
A novel pyrazole-based Co(II) complex, namely dichloro-tetrakis(1H-pyrazole)-cobalt(II), was synthesized
and characterized. Its X-ray crystal structure showed that it crystallizes in the monoclinic C 2/ c space
group ...
In–Vitro Anticancer and Antibacterial Activities of Brominated Indeno[1,2-b]qinoline Amines Supported with Molecular Docking and MCDM
(chemistry europe, nisan 2021)
The present study describes mono substituted indeno[1,2-b]quinolines (3 a–c and 5) have much more antiproliferative potentials than positive controls against A549, HeLa, MCF7 and Hep3B cell lines (IC50 values 1.1–29.6 μg/mL) ...
New anti-viral drugs for the treatment of COVID-19 instead of favipiravir
(2021)
The SARS-CoV-2 virus is a major problem in the world right now. Currently, all the attention of
research centers and governments globally are focused on the investigation of vaccination studies and
the discovery of small ...
Scale factor database for the vibration frequencies calculated in M06-2X, one of the DFT methods
(2021)
Vibrational scale factors were determined for the M06-2X method. The calculated scale factors were supported
statistically. The main objective is to determine the concordance between frequencies. Descriptive statistics ...
Investigations of Hg(II) analysis in real samples via computational chemistry, experimental design, and green microextraction approach
(Elsevier, 2021)
An economical and green nanostructured supramolecular solvent-based ultrasound-assisted homogeneous liquid-liquid microextraction procedure was developed to separate and preconcentrate Hg(II) ions in water and vegetable ...
Ultrasound-assisted supramolecular solvent dispersive liquid-liquid microextraction for preconcentration and determination of Cr(VI) in waters and total chromium in beverages and vegetables
(Elsevier, 2021)
Simple, sensitive, selective and green ultrasound assisted supramolecular solvent dispersive liquid-liquid microextraction (UA–SUPRAS-DLLME) method was developed for preconcentration and determination of chromium ions in ...
Investigations of Hg(II) analysis in real samples via computational chemistry, experimental design, and green microextraction approach
(Elsevier, 2021)
An economical and green nanostructured supramolecular solvent-based ultrasound-assisted homogeneous liquid-liquid microextraction procedure was developed to separate and preconcentrate Hg(II) ions in water and vegetable ...