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Homology modeling, force field design, and free energy simulation studies to optimize the activities of histone deacetylase inhibitors.
Hwangseo Park
Sangyoub Lee
Published in:
J. Comput. Aided Mol. Des. (2004)
Keyphrases
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simulation study
free energy
force field
image analysis
neural network
bayesian networks
upper bound
least squares
fixed point
information theory