scholarly journals Surface Orientation of Magainin 2: Molecular Dynamics Simulation and Sum Frequency Generation Vibrational Spectroscopic Studies

Langmuir ◽  
2010 ◽  
Vol 26 (20) ◽  
pp. 16031-16036 ◽  
Author(s):  
Andrew P. Boughton ◽  
Ioan Andricioaei ◽  
Zhan Chen
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Spectroscopic Studies ◽  
Surface Orientation ◽  
Sum Frequency Generation ◽  
Dynamics Simulation ◽  
Sum Frequency ◽  
Frequency Generation

Water Orientation at Ceramide/Water Interfaces Studied by Heterodyne-Detected Vibrational Sum Frequency Generation Spectroscopy and Molecular Dynamics Simulation

2016 ◽  
Vol 120 (41) ◽  
pp. 23692-23697 ◽  
Author(s):  
Aniruddha Adhikari ◽  
Suyong Re ◽  
Wataru Nishima ◽  
Mohammed Ahmed ◽  
Satoshi Nihonyanagi ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Sum Frequency Generation ◽  
Dynamics Simulation ◽  
Sum Frequency ◽  
Sum Frequency Generation Spectroscopy ◽  
Frequency Generation

Structure at the air/water interface in the presence of phenol: a study using heterodyne-detected vibrational sum frequency generation and molecular dynamics simulation

2018 ◽  
Vol 20 (5) ◽  
pp. 3002-3009 ◽  
Author(s):  
Ryoji Kusaka ◽  
Tatsuya Ishiyama ◽  
Satoshi Nihonyanagi ◽  
Akihiro Morita ◽  
Tahei Tahara
Keyword(s):  
Molecular Dynamics ◽  
Hydrogen Bonding ◽  
Molecular Dynamics Simulation ◽  
Organic Molecule ◽  
Sum Frequency Generation ◽  
Dynamics Simulation ◽  
Water Interface ◽  
Sum Frequency ◽  
Bonding Structure ◽  
Air Water Interface

A simple, neutral organic molecule, phenol, forms a specific hydrogen-bonding structure with water at the air/water interface.

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