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Long-Time Protein Folding Dynamics from Short-Time Molecular Dynamics Simulations.
John D. Chodera
William C. Swope
Jed W. Pitera
Ken A. Dill
Published in:
Multiscale Model. Simul. (2006)
Keyphrases
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protein folding
molecular dynamics
molecular dynamics simulations
secondary structure
low energy
annealing algorithm
coarse grained
protein structure
amino acids
fine grained
dynamical systems
protein structure prediction
building blocks
genetic algorithm
high performance computing