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RISHeterologous expression of a broad-spectrum chimeric antimicrobial peptide in Lactococcus lactis: Its safety and molecular modeling evaluation
Over the last decade, global increase in antibiotic consumption is a major concern in the word. Antimicrobial
peptides (AMPs) known as potential alternative and were considered as a safe antimicrobial agent. ...
Prediction of chlortetracycline adsorption on the Fe3O4 nanoparticle using molecular dynamics simulation
Molecular dynamics (MD) simulation was applied to investigate the adsorption mechanism
of chlortetracycline (CTC) antibiotic molecule as the aqueous pollutant on the Fe3O4
nanoparticle (NP). Two different NP ...
A new electrochemical aptasensor based on MWCNT-SiO2@Au core-shell nanocomposite for ultrasensitive detection of bisphenol A
Detection and quantitation of bisphenol A -BPA- level in food samples and environment are of great signifcance. In this research work, a new electrochemical aptasensor was developed for ultrasensitive detection of BPA, ...
The effect of functionalizing graphene nanosheets on adsorption of Hydroxynaphtol Blue dye, A molecular dynamics simulation
One of the most effective methods for removing many pollutants from aqueous
solutions is adsorption. Removal of particles based on adsorption is accomplished by
connecting dissolved pollutants in a stream ...
Effect of alkyl chain length on aggregation behavior of amino acid ionic liquid surfactant by molecular dynamics simulation
Amino acid ionic liquids (AAILs) with the amino acids as anion or cation have attracted
a considerable attention in green chemistry and environmental engineering. The ion
pairs possess good biodegradability ...
Interactions between water and dye atoms in the adsorption process of Acid Red-88 on graphene nanosheet: A molecular dynamics simulation
Water purification is one of the most important environmental concerns because water
is directly related to public health, energy production, economic and industrial
development Since dyes are one of the ...
Molecular Dynamics Simulation Studies of Some New Aspects of Structural and Dynamical Properties of n-Butyl Formate at Varying Temperature
Using classical molecular dynamics simulation, liquid density and isobaric expansion coefficient of n-butyl formate were studied in the temperature range 298.15 to 623.15 K. Fluctuations in ensemble volume and energy were ...
What is the effect of polar and nonpolar side chain group on bulk and electrical double layer properties of amino acid ionic liquids?
Two amino acid ionic liquids (AAILs) were investigated by molecular dynamics simulation to get effect of polar group at bulk of liquid and adsorb layer of electric double layer. Hydrogen bond plays an important role in ...
Structural analysis of an amino acid ionic liquid: Bulk and electrical double layer
The interfacial structures andmacroscopic properties of electrical double layer for 1-ethyl-3-methyl-imidazolium
phenyl alanine ([EMIM][PHE]), as anamino acid ionic liquid (AAIL), have been investigated bymolecular ...
Temperature-Dependent Density and Viscosity of the Ionic Liquids 1-Alkyl-3-methylimidazolium Iodides: Experiment and Molecular Dynamics Simulation
The density and viscosity of synthesized 1-alkyl-3-methylimidazolium iodide ([Cnmim]I, n ) 4, 6, 8) were
measured in the wide range of temperature of (298 to 393) K. Using a vacuum line, measurements of the
viscosity ...