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Use of 3D Properties to Characterize Beyond Rule-of-5 Property Space for Passive Permeation.
Cristiano R. W. Guimarães
Alan M. Mathiowetz
Marina Shalaeva
Gilles Goetz
Spiros Liras
Published in:
J. Chem. Inf. Model. (2012)
Keyphrases
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desirable properties
topological properties
key properties
data sets
website
search space
structural properties
data mining
association rules
low dimensional
e learning
case study
space time
active databases
graph properties
monotonicity property