Which data points go into the training set?
22 September 2006
SCI: Modelling the Properties and Behaviour of Molecules
35
Kennard-Stone Algorithm 1
1
Find smallest distance from candidates to objects already selected
Find largest distance among the smallest distances
The corresponding point goes into the training set
SCI: Modelling the Properties and Behaviour of Molecules 36
22 September 2006
Kennard-Stone Algorithm 2
1
Find smallest distance from candidates to objects already selected
Find largest distance among the smallest distances
The corresponding point goes into the training set
SCI: Modelling the Properties and Behaviour of Molecules 37
22 September 2006
Kennard-Stone Algorithm 3
1
Find smallest distance from candidates to objects already selected
Find largest distance among the smallest distances
The corresponding point goes into the training set
SCI: Modelling the Properties and Behaviour of Molecules 38
22 September 2006