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Comparison between self-guided langevin dynamics and molecular dynamics simulations for structure refinement of protein loop conformations.
Mark A. Olson
Sidhartha Chaudhury
Michael S. Lee
Published in:
J. Comput. Chem. (2011)
Keyphrases
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molecular dynamics simulations
protein structure
molecular dynamics
protein folding
protein structure prediction
amino acids
structural motifs
databases
protein sequences
database systems
scheduling problem
response time
numerical simulations
computational biology
protein function