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The molecular selectivity of UNC3866 inhibitor for Polycomb CBX7 protein from molecular dynamics simulation.
Hui Liu
Zhuoming Li
Liang Li
Published in:
Comput. Biol. Chem. (2018)
Keyphrases
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molecular dynamics
molecular dynamics simulations
high performance computing
scientific data
protein folding
data generation
active learning
fluid flow
database systems