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Copyright © 2013, SAS Institute Inc. All rights reserved.
EVERYTHING YOU WANTED TO KNOW
ABOUT DEFINITIVE SCREENING DESIGNS
(but were afraid to ask)
Bradley Jones
April 2014
Joint work with Chris Nachtsheim
DSDs Introduced in 2011
Paper won both the Brumbaugh and Lloyd S.
Nelson Awards
Screening Design – Wish List
1. Orthogonal main effects.
2. Main effects uncorrelated with two-factor interactions and quadratic effects.
3. Estimable quadratic effects – three-level design.
4. Small number of runs – order of the number of factors.
5. Two-factor interactions not confounded with each other.
6. Good projective properties.
Motivation: Problems with Standard Screening Designs
Resolution III designs confound main effects and two-factor interactions.
Plackett-Burman designs have “complex aliasing of the main effects by two-
factor interactions.
Resolution IV designs confound two-factor interactions with each other, so if
one is active, you usually need further runs to resolve the active effects.
Center runs give an overall measure of curvature but you do not know which
factor(s) are causing the curvature.
Example: JMP Demo
Solution: Definitive Screening Designs
1. Orthogonal for the main effects.
2. The number of required runs is only one more than twice the number of factors. ***
3. Unlike resolution III designs, main effects are independent of two-factor interactions.
4. Unlike resolution IV designs, two-factor interactions are not completely confounded with
other two-factor interactions, although they may be correlated
5. Unlike resolution III, IV and V designs with added center points, all quadratic effects are
estimable in models comprised of any number of linear and quadratic main effects terms.
6. Quadratic effects are orthogonal to main effects and not completely confounded (though
correlated) with interaction effects.
7. If there are more than six factors, the designs are capable of efficiently estimating all
possible full quadratic models involving three or fewer factors
Six factor DSD table.
6 factors and 13 runs.
Run A B C D E F
1 0 1 -1 -1 -1 -1
2 0 -1 1 1 1 1
3 1 0 -1 1 1 -1
4 -1 0 1 -1 -1 1
5 -1 -1 0 1 -1 -1
6 1 1 0 -1 1 1
7 -1 1 1 0 1 -1
8 1 -1 -1 0 -1 1
9 1 -1 1 -1 0 -1
10 -1 1 -1 1 0 1
11 1 1 1 1 -1 0
12 -1 -1 -1 -1 1 0
13 0 0 0 0 0 0
DSD structure – 1
Run A B C D E F
1 0 1 -1 -1 -1 -1
2 0 -1 1 1 1 1
3 1 0 -1 1 1 -1
4 -1 0 1 -1 -1 1
5 -1 -1 0 1 -1 -1
6 1 1 0 -1 1 1
7 -1 1 1 0 1 -1
8 1 -1 -1 0 -1 1
9 1 -1 1 -1 0 -1
10 -1 1 -1 1 0 1
11 1 1 1 1 -1 0
12 -1 -1 -1 -1 1 0
13 0 0 0 0 0 0
Six fold-over
pairs
DSD structure – 2
Run A B C D E F
1 0 1 -1 -1 -1 -1
2 0 -1 1 1 1 1
3 1 0 -1 1 1 -1
4 -1 0 1 -1 -1 1
5 -1 -1 0 1 -1 -1
6 1 1 0 -1 1 1
7 -1 1 1 0 1 -1
8 1 -1 -1 0 -1 1
9 1 -1 1 -1 0 -1
10 -1 1 -1 1 0 1
11 1 1 1 1 -1 0
12 -1 -1 -1 -1 1 0
13 0 0 0 0 0 0
Center value in
each row
DSD structure – 3
Run A B C D E F
1 0 1 -1 -1 -1 -1
2 0 -1 1 1 1 1
3 1 0 -1 1 1 -1
4 -1 0 1 -1 -1 1
5 -1 -1 0 1 -1 -1
6 1 1 0 -1 1 1
7 -1 1 1 0 1 -1
8 1 -1 -1 0 -1 1
9 1 -1 1 -1 0 -1
10 -1 1 -1 1 0 1
11 1 1 1 1 -1 0
12 -1 -1 -1 -1 1 0
13 0 0 0 0 0 0
One overall
center run.
How do you make a DSD?
DSDs are constructed using conference matrices
What is a conference matrix?
An mxm square matrix C with 0 diagonal and +1 or -1 off
diagonal elements so that:
CT
C  (m 1)Imm
Sample Conference Matrix
For six factors the model of interest has 6 main effects and 15 interactions.
But n = 12, so we can only fit the intercept and the main effects:
Standard result: some main effects estimates are biased:
where the “alias” matrix is:
Screening Conundrum 1 – Two Models
14
Alias Matrices
For the DSD there is no aliasing between main effects and two-factor interactions.
The D-optimal design (AKA Plackett-Burman) with one added center point has
substantial aliasing of each main effect with a number of two-factor interactions.
Column Correlations for 6 factor DSD
0.25
0.5
0.4655
0.1333
0.0
Are there any trade-offs versus the D-optimal
design with an added center run?
Confidence intervals for the main effects are a little less than 10% longer.
Screening Conundrum 2 – Confounding
Resolution IV designs confound two-factor
interactions with each other.
So, if some two-factor interaction is large, you are
left with ambiguity about which model is correct.
Correlation Cell Plot for 8 Factor Screening Design
AB is
confounded with
CE, DH & FG
AB FG r = 1
AB DH r = 1
AB CE r = 1
Correlation Cell Plot for 8 Factor DSD
|r| = 2/3
|r| = 1/6
r = 0
What if some factors are categorical?
DSD with categorical factors - construction
Change pairs of
zeros to different
levels
DSD with a 2-level categorical factor
|r| = 0.169
|r| = 0.68
|r| = 0.5
|r| = 0.25
What if you want to block a DSD?
In revision with Technometrics
Constructing Orthogonally Blocked DSDs
1. Create DSD in standard order
2. Create blocks from groups of fold-over pairs
3. If you have all continuous factors, add one center
run per block to estimate quadratic effects
4. If you have categorical factors, add pairs of center
runs to estimate quadratic effects*
* How many pairs do I need? Answer on next slide.
How many pairs?
1. Let n be the number of runs in the conference
matrix, m be the number of continuous factors
and b be the desired number of blocks.
2. Add b – (n – m) pairs of center runs
Table of Orthogonal Blocking Alternatives
Ideas for analysis of DSDs
Simplest idea – fit the main effects model.
The main effects are not biased so you can believe
their magnitude. Unfortunately, if there are strong
interaction or quadratic effects, the RMSE, which
estimates s, will be inflated.
Idea #2 for Analysis
Use a version of stepwise regression
Model:
all main effects
all quadratic effects
all two-factor interactions
Idea #2 for Analysis
Procedure:
1. Enter all main effects
2. Add any large quadratic effect
3. Add any large two-factor interaction
4. Remove any main effect that is small and not
featured in any 2nd order effect
5. Beware of models with more than n/2 terms
because of possible over-fitting
Idea #3 for Analysis
Use a version of all subsets regression
Model:
all main effects
all quadratic effects
all two-factor interactions
n/2 - 1
Recapitulation – Definitive Screening Design
1. Orthogonal main effects plans.
2. Two-factor interactions are uncorrelated with main effects.
3. Quadratic effects are uncorrelated with main effects.
4. All quadratic effects are estimable.
5. The number of runs is only one more than twice the number of factors.
6. For six factors or more, the designs can estimate all possible full quadratic
models involving three or fewer factors
References
1. Box, G. E. P. and J. S. Hunter (2008). The 2k−p fractional factorial designs.
Technometrics 3, 449–458.
2. Goethals, J. and Seidel, J. (1967). ”Orthogonal matrices with zero diagonal”.
Canadian Journal of Mathematics, 19, pp. 1001–1010.
3. Tsai, P. W., Gilmour, S. G., and R. Mead (2000). Projective three-level main
effects designs robust to model uncertainty. Biometrika 87, 467–475.
4. Jones, B. and Nachtsheim, C. J. (2011) “Efficient Designs with Minimal
Aliasing” Technometrics, 53. 62-71.
5. Jones, B and Nachtsheim, C. (2011) “A Class of Three-Level Designs for
Definitive Screening in the Presence of Second-Order Effects” Journal of
Quality Technology, 43. 1-15.

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Everything You Wanted to Know About Definitive Screening Designs

  • 1. Copyright © 2013, SAS Institute Inc. All rights reserved. EVERYTHING YOU WANTED TO KNOW ABOUT DEFINITIVE SCREENING DESIGNS (but were afraid to ask) Bradley Jones April 2014
  • 2. Joint work with Chris Nachtsheim
  • 4. Paper won both the Brumbaugh and Lloyd S. Nelson Awards
  • 5. Screening Design – Wish List 1. Orthogonal main effects. 2. Main effects uncorrelated with two-factor interactions and quadratic effects. 3. Estimable quadratic effects – three-level design. 4. Small number of runs – order of the number of factors. 5. Two-factor interactions not confounded with each other. 6. Good projective properties.
  • 6. Motivation: Problems with Standard Screening Designs Resolution III designs confound main effects and two-factor interactions. Plackett-Burman designs have “complex aliasing of the main effects by two- factor interactions. Resolution IV designs confound two-factor interactions with each other, so if one is active, you usually need further runs to resolve the active effects. Center runs give an overall measure of curvature but you do not know which factor(s) are causing the curvature. Example: JMP Demo
  • 7. Solution: Definitive Screening Designs 1. Orthogonal for the main effects. 2. The number of required runs is only one more than twice the number of factors. *** 3. Unlike resolution III designs, main effects are independent of two-factor interactions. 4. Unlike resolution IV designs, two-factor interactions are not completely confounded with other two-factor interactions, although they may be correlated 5. Unlike resolution III, IV and V designs with added center points, all quadratic effects are estimable in models comprised of any number of linear and quadratic main effects terms. 6. Quadratic effects are orthogonal to main effects and not completely confounded (though correlated) with interaction effects. 7. If there are more than six factors, the designs are capable of efficiently estimating all possible full quadratic models involving three or fewer factors
  • 8. Six factor DSD table. 6 factors and 13 runs. Run A B C D E F 1 0 1 -1 -1 -1 -1 2 0 -1 1 1 1 1 3 1 0 -1 1 1 -1 4 -1 0 1 -1 -1 1 5 -1 -1 0 1 -1 -1 6 1 1 0 -1 1 1 7 -1 1 1 0 1 -1 8 1 -1 -1 0 -1 1 9 1 -1 1 -1 0 -1 10 -1 1 -1 1 0 1 11 1 1 1 1 -1 0 12 -1 -1 -1 -1 1 0 13 0 0 0 0 0 0
  • 9. DSD structure – 1 Run A B C D E F 1 0 1 -1 -1 -1 -1 2 0 -1 1 1 1 1 3 1 0 -1 1 1 -1 4 -1 0 1 -1 -1 1 5 -1 -1 0 1 -1 -1 6 1 1 0 -1 1 1 7 -1 1 1 0 1 -1 8 1 -1 -1 0 -1 1 9 1 -1 1 -1 0 -1 10 -1 1 -1 1 0 1 11 1 1 1 1 -1 0 12 -1 -1 -1 -1 1 0 13 0 0 0 0 0 0 Six fold-over pairs
  • 10. DSD structure – 2 Run A B C D E F 1 0 1 -1 -1 -1 -1 2 0 -1 1 1 1 1 3 1 0 -1 1 1 -1 4 -1 0 1 -1 -1 1 5 -1 -1 0 1 -1 -1 6 1 1 0 -1 1 1 7 -1 1 1 0 1 -1 8 1 -1 -1 0 -1 1 9 1 -1 1 -1 0 -1 10 -1 1 -1 1 0 1 11 1 1 1 1 -1 0 12 -1 -1 -1 -1 1 0 13 0 0 0 0 0 0 Center value in each row
  • 11. DSD structure – 3 Run A B C D E F 1 0 1 -1 -1 -1 -1 2 0 -1 1 1 1 1 3 1 0 -1 1 1 -1 4 -1 0 1 -1 -1 1 5 -1 -1 0 1 -1 -1 6 1 1 0 -1 1 1 7 -1 1 1 0 1 -1 8 1 -1 -1 0 -1 1 9 1 -1 1 -1 0 -1 10 -1 1 -1 1 0 1 11 1 1 1 1 -1 0 12 -1 -1 -1 -1 1 0 13 0 0 0 0 0 0 One overall center run.
  • 12. How do you make a DSD? DSDs are constructed using conference matrices What is a conference matrix? An mxm square matrix C with 0 diagonal and +1 or -1 off diagonal elements so that: CT C  (m 1)Imm
  • 14. For six factors the model of interest has 6 main effects and 15 interactions. But n = 12, so we can only fit the intercept and the main effects: Standard result: some main effects estimates are biased: where the “alias” matrix is: Screening Conundrum 1 – Two Models 14
  • 15. Alias Matrices For the DSD there is no aliasing between main effects and two-factor interactions. The D-optimal design (AKA Plackett-Burman) with one added center point has substantial aliasing of each main effect with a number of two-factor interactions.
  • 16. Column Correlations for 6 factor DSD 0.25 0.5 0.4655 0.1333 0.0
  • 17. Are there any trade-offs versus the D-optimal design with an added center run? Confidence intervals for the main effects are a little less than 10% longer.
  • 18. Screening Conundrum 2 – Confounding Resolution IV designs confound two-factor interactions with each other. So, if some two-factor interaction is large, you are left with ambiguity about which model is correct.
  • 19. Correlation Cell Plot for 8 Factor Screening Design AB is confounded with CE, DH & FG AB FG r = 1 AB DH r = 1 AB CE r = 1
  • 20. Correlation Cell Plot for 8 Factor DSD |r| = 2/3 |r| = 1/6 r = 0
  • 21. What if some factors are categorical?
  • 22. DSD with categorical factors - construction Change pairs of zeros to different levels
  • 23. DSD with a 2-level categorical factor |r| = 0.169 |r| = 0.68 |r| = 0.5 |r| = 0.25
  • 24. What if you want to block a DSD? In revision with Technometrics
  • 25. Constructing Orthogonally Blocked DSDs 1. Create DSD in standard order 2. Create blocks from groups of fold-over pairs 3. If you have all continuous factors, add one center run per block to estimate quadratic effects 4. If you have categorical factors, add pairs of center runs to estimate quadratic effects* * How many pairs do I need? Answer on next slide.
  • 26. How many pairs? 1. Let n be the number of runs in the conference matrix, m be the number of continuous factors and b be the desired number of blocks. 2. Add b – (n – m) pairs of center runs
  • 27. Table of Orthogonal Blocking Alternatives
  • 28. Ideas for analysis of DSDs Simplest idea – fit the main effects model. The main effects are not biased so you can believe their magnitude. Unfortunately, if there are strong interaction or quadratic effects, the RMSE, which estimates s, will be inflated.
  • 29. Idea #2 for Analysis Use a version of stepwise regression Model: all main effects all quadratic effects all two-factor interactions
  • 30. Idea #2 for Analysis Procedure: 1. Enter all main effects 2. Add any large quadratic effect 3. Add any large two-factor interaction 4. Remove any main effect that is small and not featured in any 2nd order effect 5. Beware of models with more than n/2 terms because of possible over-fitting
  • 31. Idea #3 for Analysis Use a version of all subsets regression Model: all main effects all quadratic effects all two-factor interactions n/2 - 1
  • 32. Recapitulation – Definitive Screening Design 1. Orthogonal main effects plans. 2. Two-factor interactions are uncorrelated with main effects. 3. Quadratic effects are uncorrelated with main effects. 4. All quadratic effects are estimable. 5. The number of runs is only one more than twice the number of factors. 6. For six factors or more, the designs can estimate all possible full quadratic models involving three or fewer factors
  • 33. References 1. Box, G. E. P. and J. S. Hunter (2008). The 2k−p fractional factorial designs. Technometrics 3, 449–458. 2. Goethals, J. and Seidel, J. (1967). ”Orthogonal matrices with zero diagonal”. Canadian Journal of Mathematics, 19, pp. 1001–1010. 3. Tsai, P. W., Gilmour, S. G., and R. Mead (2000). Projective three-level main effects designs robust to model uncertainty. Biometrika 87, 467–475. 4. Jones, B. and Nachtsheim, C. J. (2011) “Efficient Designs with Minimal Aliasing” Technometrics, 53. 62-71. 5. Jones, B and Nachtsheim, C. (2011) “A Class of Three-Level Designs for Definitive Screening in the Presence of Second-Order Effects” Journal of Quality Technology, 43. 1-15.