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Exploring the molecular basis of UG-rich RNA recognition by the human splicing factor TDP-43 using molecular dynamics simulation and free energy calculation.
Han Sun
Wei Chen
Lin Chen
Wenqing Zheng
Published in:
J. Comput. Chem. (2021)
Keyphrases
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molecular dynamics
free energy
molecular dynamics simulations
high performance computing
scientific data
rna structures
protein folding
rna sequences
upper bound
fluid flow
belief propagation
fixed point
secondary structure
massively parallel
machine learning
competitive learning
unsupervised learning
pairwise