Conformation and solvation structure for an isolated n-octadecane chain in water, methanol, and their mixtures

Keyphrases

• Methanol-water Mixture 100%
• Solvation Structure 100%
• Octadecane 100%
• Conformation Structure 100%
• Gas Phase 33%
• Methanol 33%
• Methyl 33%
• Solvate 33%
• Methylene 33%
• Water-rich 33%
• Phase Equilibria 16%
• Monte Carlo Simulation 16%
• Two-state 16%
• Force Field 16%
• Structural Properties 16%
• Mixed Solvent 16%
• Methyl Groups 16%
• Simulation Data 16%
• United Atom 16%
• Dihedral Angle 16%
• Conformational Distribution 16%
• Globular 16%
• Hydrophobic Nature 16%
• Chain End 16%
• Basin of Attraction 16%
• Solvent Environment 16%
• 4P Model 16%
• Rich Solvent 16%
• Rich Mixture 16%
• End Contact 16%
• Configurational Bias Monte Carlo 16%
• Small Fraction 16%
• Isobaric-isothermal Ensemble 16%
• Poor Solvent 16%
• All-trans Conformation 16%

Chemistry

• Solvation 100%
• Methanol 100%
• Octadecane 100%
• Carbene 33%
• Phase Equilibria 16%
• Monte Carlo Method 16%
• Dihedral Angle 16%
• Methyl Group 16%
• Solvent Mixture 16%
• Configurational Bias Monte Carlo 16%
• Isothermal Ensemble 16%
• Statistical Ensemble 16%

Biochemistry, Genetics and Molecular Biology

• Conformation 100%
• Solvation 100%
• Dihedral Angle 25%