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Combining optimal control theory and molecular dynamics for protein folding
Yaman Arkun
*
,
Mert Gur
*
Corresponding author for this work
Koc University
University of Pittsburgh
Research output
:
Contribution to journal
›
Article
›
peer-review
9
Citations (Scopus)
Overview
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Keyphrases
Molecular Dynamics
100%
Protein Folding
100%
Optimal Control Theory
100%
Molecular Dynamics Simulation
42%
Target Position
28%
All-atom
28%
Low Energy
14%
Force Field
14%
Dynamical Processes
14%
Native State
14%
Bias Potential
14%
Model Proteins
14%
Potential Energy Surface
14%
Optimal Trajectory
14%
Folding Time
14%
Harmonic Approximation
14%
Dynamic Software
14%
Optimal Target
14%
Targeted Molecular Dynamics
14%
Active Contact
14%
Simulation Cycle
14%
Coarse-grained Potential
14%
Coarse-grained Protein Models
14%
Harmonic Restraint
14%
Villin
14%
Dynamic Potential
14%
Biochemistry, Genetics and Molecular Biology
Dynamics
100%
Protein Folding
100%
Computer Simulation
37%
Conformation
25%
Solution and Solubility
12%
Villin
12%