Path lumping: An efficient algorithm to identify metastable path channels for conformational dynamics of multi-body systems

Keyphrases

• Kinetic Mechanism 100%
• Conformational Dynamics 100%
• Parallel Pathways 100%
• Multibody 100%
• Multibody Systems 100%
• Markov State Model 100%
• Molecular Dynamics Simulation 50%
• Hydrophobic Drugs 50%
• Two-pathway 50%
• Biological Processes 50%
• Trajectory Simulation 50%
• Energy Channels 50%
• Spectral Clustering Algorithm 50%
• Intercross 50%
• Transition Path Theory 50%
• Hydrophobic Collapse 50%
• Conformational States 50%
• Complex Chemical Processes 50%
• Multiscale Molecular Dynamics 50%
• Lumped Method 50%
• Collapse Process 50%
• 2D Potential 50%

Biochemistry, Genetics and Molecular Biology

• Dynamics 100%
• Kinetics 100%
• Computer Simulation 50%
• Biological Phenomena and Functions Concerning the Entire Organism 50%
• Hydrophobic Collapse 50%