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Adaptive patch grid strategy for parallel protein folding using atomic burials with NAMD.
Emerson de Araujo Macedo
Alba C. M. A. Melo
Published in:
J. Parallel Distributed Comput. (2024)
Keyphrases
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protein folding
adaptive strategies
low energy
annealing algorithm
regular grid
fine grained
image patches
grid computing
coarse grained
molecular dynamics
structural motifs
protein sequences
secondary structure
bayesian networks
amino acids