Quantum chemistry: Molecular dynamics study of the dark-adaptation process in bacteriorhodopsin

Keyphrases

• Adaptation Process 100%
• Quantum Chemistry 100%
• Bacteriorhodopsin 100%
• Molecular Dynamics Study 100%
• Dark Adaptation 100%
• Molecular Dynamics Simulation 25%
• Ab Initio Calculations 25%
• Isomerization 25%
• Protonation 25%
• Charge Distribution 25%
• Aspartic Acid 25%
• Molecular Dynamics Trajectories 25%
• Quantum Chemical Calculations 25%
• Thermally Activated Processes 25%
• Potential Surface 25%
• Dynamic Quantum 25%
• Double Bond 25%
• Thermal Fluctuations 25%
• All-atom 25%
• Point Charge 25%
• Thermal Isomerization 25%
• Isomerization Mechanism 25%
• Complete Active Space Self-consistent Field (CASSCF) 25%
• Effective Reduction 25%
• Protein Configuration 25%
• Electronic Hamiltonian 25%

Chemistry

• Isomerization 100%
• Molecular Dynamics Study 100%
• Quantum Chemistry 100%
• Molecular Dynamics 66%
• Ab Initio Calculation 33%
• Surface Potential 33%
• Aspartic Acid 33%
• Charge Distribution 33%
• Double Bond 33%
• CASSCF Calculation 33%