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Optimizing the Performance of In Silico ADMET General Models According to Local Requirements: MARS Approach. Solubility Estimations As Case Study.
Julen Oyarzabal
Joaquin Pastor
Trevor J. Howe
Published in:
J. Chem. Inf. Model. (2009)
Keyphrases
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case study
probabilistic model
statistical models
real world
database
classification models
computer simulation
application specific
autoregressive
experimental data
statistical model
process model
closely related
parameter estimation
support vector machine
genetic algorithm
machine learning
data mining