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All-atom empirical force field for nucleic acids: I. Parameter optimization based on small molecule and condensed phase macromolecular target data.
Nicolas Foloppe
Alexander D. MacKerell Jr.
Published in:
J. Comput. Chem. (2000)
Keyphrases
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prior knowledge
parameter optimization
machine learning
image sequences
similarity measure
training data
multi objective
least squares
global optimization
force field