Kinetically-aware Conformational Distances in Molecular Dynamics.

Chen Gu Xiaoye Jiang Leonidas J. Guibas

Published in: CCCG (2011)

Keyphrases

molecular dynamics
protein folding
molecular dynamics simulations
high performance computing
secondary structure
scientific data
fluid flow
coarse grained
protein sequences
amino acids
databases
protein structure
data mining
fine grained
operating system
data analysis
information systems