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An atomistic model of passive membrane permeability: application to a series of FDA approved drugs.
Chakrapani Kalyanaraman
Matthew P. Jacobson
Published in:
J. Comput. Aided Mol. Des. (2007)
Keyphrases
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mathematical model
high level
computational model
experimental data
data sets
cost function
probabilistic model
model driven
prior knowledge
theoretical framework
statistical model
formal model
network model