In this study, the shake-flask method was used to determine the solubility of lamotrigine (LTG) in non-aqueous mixtures of polyethylene glycol 400 (PEG 400) and 2-propanol at temperatures of 293.15 to 313.15 K. Five main ...

To assess the effect of missense variants and the degree of pathogenicity of each nsSNP on the function, structure, and stability of the glucokinase protein (GCK), several algorithms were utilized including PHD-SNP, PROVEAN, ...

DFT calculations was applied for modelling ascorbic acid in three homologous sulfoxides solvents including methyl, ethyl, and propyl groups using 6-31++G** basis sets in B3LYP level. NBO analysis was performed to evaluate ...

Cooling enhancement by mixed convection in a tilted enclosure heated on one wall and vented by injecting or sucking an imposed flow by Alumina-water nanofluid has been analyzed. The inclination angle, 0°    90°, the ...

Selected monoclonal antibody molecules were conducted using the antibody–antigen docking mode, as well as the antibody-antigen docking approach.Objective of the study was to check effects of CetuximabCOVID-19 proteins ...

In the present study, undecan-1-ol was used as an extractant to remove caproic acid from aqueous phase. Experimental tie-line data of the ternary system (water + caproic acid + undecan-1-ol) were measured at T = 298.2 K ...

Recent works in green solvents research trend towards ternary deep eutectic solvents (DESs) as a breakthrough which enhanced the performance of biomass dissolution and tunability of DESs for varying applications. In this ...

Medicinal plants belonging to Cameroon flora, could be a source for the discovery of potential inhibitors of SARS-CoV-2. These two proteins play a pivotal role in mediating viral replication and transcription, making them ...

The synthesis and characterization of ZnS dandelion-like nanoparticles (NPs) via simple and template-free sonochemical method are reported. The elimination of an organic dye methylene blue (MB) as an organic pollutant from ...

Quantum mechanical study on the interaction between carcinogens and DNA nucleobase is an exciting and significant aspect in cancer research. Common aromatic carcinogens like; β-napthylamine, α-benzopyrone, phthalazine, ...

In this study, the molecular and atomic adsorption energies, and total density of states (DOS) of the hydrogen on the on-top, bridge, and hollow positions of FCC (100), and FCC (111) surfaces of the metallic platinum were ...

During this work, we studied the reactivity of 4-isothiazolin-3-one and 2-methyl-4-isothiazolin-3-one with Dibromine and with Sulfuryl Chloride by the DFT method at the level of base 6-311 G(d,p), using a descriptor of ...

With the aim of eliminating toluene as volatile organic compound, a collection of Pt-(Sn/Re)-HZSM-5/HMS catalysts with different weight percent of Sn/Re have been synthesized. Also, the catalytic performances of the prepared ...

Uricase is widely used to treat hyperuricemia and gout. Its clinical use is complicated by patients severe allergy, hypersensitivity and anaphylactic reactions. Uricase from Arthrobacter globiformis (Ag) and Bacillus ...

Modulation of photophysical properties and entrapping of fluorescence drug molecules in microhetrogeneous systems are embracing potential applications in therapeutic pursuit. The present contribution describes the fascinating ...

A virtual screening protocol, by combining on 3D-QSAR model with molecular docking procedure and prediction of physico-chemical properties, was applied to find novel inhibitors of Enoyl ACP reductase against M. tuberculosis. ...