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Predicting three-dimensional structure of protein fragments from dihedral angle propensities and molecular dynamics.
Jaine K. Blayney
Piyush C. Ojha
Mary Shapcott
Published in:
Int. J. Comput. Biol. Drug Des. (2010)
Keyphrases
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molecular dynamics
three dimensional
molecular structures
molecular dynamics simulations
scientific data
high performance computing
database systems
distributed systems
protein folding
fluid flow
response time
multi view
surface reconstruction
data generation
contact map