First-Principles Modeling of Protein/Surface Interactions. Polyglycine Secondary Structure Adsorption on the TiO2 (101) Anatase Surface Adopting a Full Periodic Approach

Chemistry

• Adsorption 100%
• Surface 58%
• Peptide 33%
• Protein 25%
• Secondary Structure 25%
• Solvation 16%
• Titanium Dioxide 16%
• First Principle 16%
• Chemical Bond 16%
• Solvent 16%
• Concentration 16%
• Computer Simulation 16%
• Density Functional Theory 8%
• Hydrogen Bond 8%
• Polypeptide 8%
• Gas 8%
• Group 8%
• Atom 8%
• Water Type 8%
• Number 8%
• Amino Acid 8%
• Conformation 8%
• Periodic Boundary Condition 8%
• Point Group D2 8%

Material Science

• Titanium Dioxide 66%
• Surface 58%
• Peptide 33%
• Protein 25%
• Solvent 16%
• Amino Acids 8%
• Gas 8%
• Strand 8%

Computer Science

• Secondary Structure 25%
• Surface Interaction 16%
• Molecular Dynamics Simulation 16%
• Paramount Importance 8%
• Simulated Environment 8%