Optimal designs for the Michaelis–Menten model with correlated observations

In this paper we investigate the problem of designing experiments for generalized least-squares analysis in the Michaelis–Menten model. We study the structure of exact D-optimal designs in a model with an autoregressive error structure. Explicit results for locally D-optimal designs are derived for the case where two observations can be taken per subject. Additionally standardized maximin D-optimal designs are obtained in this case. The results illustrate the enormous difficulties to find exact optimal designs explicitly for nonlinear regression models with correlated observations.     

A-optimal designs for heteroscedastic multifactor regression models

Abstract

This paper searches for A-optimal designs for Kronecker product and additive regression models when the errors are heteroscedastic. Sufficient conditions are given so that A-optimal designs for the multifactor models can be built from A-optimal designs for their sub-models with a single factor. The results of an efficiency study carried out to check the adequacy of the products of optimal designs for uni-factor marginal models when these are used to estimate different multi-factor models are also reported.     

Optimal Designs for Random Coefficient Regression Models with Heteroscedastic Errors

The purpose of this article is to present the optimal designs based on D-, G-, A-, I-, and D _β-optimality criteria for random coefficient regression (RCR) models with heteroscedastic errors. A sufficient condition for the heteroscedastic structure is given to make sure that the search of optimal designs can be confined at extreme settings of the design region when the criteria satisfy the assumption of the real valued monotone design criteria. Analytical solutions of D-, G-, A-, I-, and D _β-optimal designs for the RCR models are derived. Two examples are presented for random slope models with specific heteroscedastic errors.     

Locally optimal designs for some dose–response models with continuous endpoints

We consider the problem of constructing static (or non sequential), approximate optimal designs for a class of dose–response models with continuous outcomes. We obtain conditions for a design being D-optimal or c-optimal. The designs are locally optimal in that they depend on the model parameters. The efficiency studies show that these designs have high efficiency when the mis-specification of the initial values of model parameters is not severe. A case study indicates that using an optimal design may result in a significant saving of resources.     

A new characterization of Elfving's method for high dimensional computation

We give a new characterization of Elfving's (1952) method for computing c-optimal designs in k dimensions which gives explicit formulae for the k unknown optimal weights and k unknown signs in Elfving's characterization. This eliminates the need to search over these parameters to compute c-optimal designs, and thus reduces the computational burden from solving a family of optimization problems to solving a single optimization problem for the optimal finite support set. We give two illustrative examples: a high dimensional polynomial regression model and a logistic regression model, the latter showing that the method can be used for locally optimal designs in nonlinear models as well.     

Optimal designs for non-competitive enzyme inhibition kinetic models

In this paper, we present a new method for determining optimal designs for enzyme inhibition kinetic models, which are used to model the influence of the concentration of a substrate and an inhibition on the velocity of a reaction. The approach uses a nonlinear transformation of the vector of predictors such that the model in the new coordinates is given by an incomplete response surface model. Although there exist no explicit solutions of the optimal design problem for incomplete response surface models so far, the corresponding design problem in the new coordinates is substantially more transparent, such that explicit or numerical solutions can be determined more easily. The designs for the original problem can finally be found by an inverse transformation of the optimal designs determined for the response surface model. We illustrate the method determining explicit solutions for the D-optimal design and for the optimal design problem for estimating the individual coefficients in a non-competitive enzyme inhibition kinetic model.     

Optimal designs for the logit and probit models for binary data

We consider optimal designs for a class of symmetric models for binary data which includes the common probit and logit models. We show that for a large group of optimality criteria which includes the main ones in the literature (e.g. A-, D-, E-, F- and G-optimality) the optimal design for our class of models is a two-point design with support points symmetrically placed about the ED50 but with possibly unequal weighting. We demonstrate how one can further reduce the problem to a one-variable optimization by characterizing various of the common criteria. We also use the results to demonstrate major qualitative differences between the F - and c-optimal designs, two design criteria which have similar motivation.     

Highly Efficient Designs for Logistic Models with Categorical Variables

Optimal designs for logistic models generally require prior information about the values of the regression parameters. However, experimenters usually do not have full knowledge of these parameters. We propose a design that is D-optimal on a restricted design region. This design assigns an equal weight to design points that contain more information and ignores those design points that contain less information about the regression parameters. The design can be constructed in practice by means of the rank order of the outcome variances. A numerical study compares the proposed design with the D-optimal and completely balanced designs in terms of efficiency.     

E- and R-optimality of block designs for treatment-control comparisons

Abstract

We study optimal block designs for comparing a set of test treatments with a control treatment. We provide the class of all E-optimal approximate block designs, which is characterized by simple linear constraints. Based on this characterization, we obtain a class of E-optimal exact designs for unequal block sizes. In the studied model, we provide a statistical interpretation for wide classes of E-optimal designs. Moreover, we show that all approximate A-optimal designs and a large class of A-optimal exact designs for treatment-control comparisons are also R-optimal. This reinforces the observation that A-optimal designs perform well even for rectangular confidence regions.     

Optimal designs for statistical analysis with Zernike polynomials

The Zernike polynomials arise in several applications such as optical metrology or image analysis on a circular domain. In the present paper, we determine optimal designs for regression models which are represented by expansions in terms of Zernike polynomials. We consider two estimation methods for the coefficients in these models and determine the corresponding optimal designs. The first one is the classical least squares method and Φ _p -optimal designs in the sense of Kiefer [Kiefer, J., 1974, General equivalence theory for optimum designs (approximate theory). Annals of Statistics, 2 849–879.] are derived, which minimize an appropriate functional of the covariance matrix of the least squares estimator. It is demonstrated that optimal designs with respect to Kiefer's Φ _p -criteria (p>?∞) are essentially unique and concentrate observations on certain circles in the experimental domain. E-optimal designs have the same structure but it is shown in several examples that these optimal designs are not necessarily uniquely determined. The second method is based on the direct estimation of the Fourier coefficients in the expansion of the expected response in terms of Zernike polynomials and optimal designs minimizing the trace of the covariance matrix of the corresponding estimator are determined. The designs are also compared with the uniform designs on a grid, which is commonly used in this context.     

Model-Robust Design of Conjoint Choice Experiments

Within the context of choice experimental designs, most authors have proposed designs for the multinomial logit model under the assumption that only the main effects matter. Very little attention has been paid to designs for attribute interaction models. In this article, three types of Bayesian D-optimal designs for the multinomial logit model are studied: main-effects designs, interaction-effects designs, and composite designs. Simulation studies are used to show that in situations where a researcher is not sure whether or not attribute interaction effects are present, it is best to take into account interactions in the design stage. In particular, it is shown that a composite design constructed by including an interaction-effects model and a main-effects model in the design criterion is most robust against misspecification of the underlying model when it comes to making precise predictions.     

Bayesian and maximin optimal designs for heteroscedastic regression models

The authors consider the problem of constructing standardized maximin D‐optimal designs for weighted polynomial regression models. In particular they show that by following the approach to the construction of maximin designs introduced recently by Dette, Haines & Imhof (2003), such designs can be obtained as weak limits of the corresponding Bayesian _q‐optimal designs. They further demonstrate that the results are more broadly applicable to certain families of nonlinear models. The authors examine two specific weighted polynomial models in some detail and illustrate their results by means of a weighted quadratic regression model and the Bleasdale–Nelder model. They also present a capstone example involving a generalized exponential growth model.     

Locally and maximin optimal designs for multi-factor nonlinear models

This paper considers the search for locally and maximin optimal designs for multi-factor nonlinear models from optimal designs for sub-models of a lower dimension. In particular, sufficient conditions are given so that maximin D-optimal designs for additive multi-factor nonlinear models can be built from maximin D-optimal designs for their sub-models with a single factor. Some examples of application are models involving exponential decay in several variables.     

Optimal design for nonlinear regression models

Two results for D _θ-optimal designs for nonlinear regression models are shown to follow directly from approximate design theory. The first result considered is one concerning the replication of exact designs with minimum support, first established by Atkinson and Hunter and by M.J. Box in 1968, while the second pertains to a heteroscedastic model introduced by Velilla and Llosa in 1992. An illustrative example is provided.     

An algorithm for calculating D-optimal designs for polynomial regression through a fixed point

Optimal designs are required to make efficient statistical experiments. By using canonical moments, in 1980, Studden found D_s-optimal designs for polynomial regression models. On the other hand, integrable systems are dynamical systems whose solutions can be written down concretely. In this paper, polynomial regression models through a fixed point are discussed. In order to calculate D-optimal designs for these models, a useful relationship between canonical moments and discrete integrable systems is introduced. By using canonical moments and discrete integrable systems, a new algorithm for calculating D-optimal designs for these models is proposed.     

Optimal designs for additive mixture model with heteroscedastic errors

This paper presents a study of D- and A-optimality of direct sum designs for additive mixture models when the errors are heteroscedastic. Sufficient conditions are given so that D- and A-optimal designs for additive mixture models can be constructed from the D- and A-optimal designs for homogeneous models in sub-mixture systems.     

D s -optimal designs for Kozak's tree taper model

In this work, we study D _s -optimal design for Kozak's tree taper model. The approximate D _s -optimal designs are found invariant to tree size and hence create a ground to construct a general replication-free D _s -optimal design. Even though the designs are found not to be dependent on the parameter value p of the Kozak's model, they are sensitive to the s×1 subset parameter vector values of the model. The 12 points replication-free design (with 91% efficiency) suggested in this study is believed to reduce cost and time for data collection and more importantly to precisely estimate the subset parameters of interest.     

The analytic construction of D-optimal designs for the two-variable binary logistic regression model without interaction

Candidate locally D-optimal designs for the binary two-variable logistic model with no interaction, which comprise 3 and 4 support points lying in the first quadrant of the two-dimensional Euclidean space, were introduced by Haines et al. (D-optimal designs for logistic regression in two variables. In: Lopez-Fidalgo J, Rodrigez-Diaz JM, Torsney B, editors. MODA8 – advances in model-oriented designs and analysis. Heidelberg: Physica-Verlag; 2007. p. 91–98). The authors proved algebraically the global D-optimality of the 3-point design for the special case in which the intercept parameter is equal to?1.5434. However for other selected values of the intercept parameter, the global D-optimality of the proposed 3- and 4-point designs was only demonstrated numerically. In this paper, we provide analytical proofs of the D-optimality of these 3- and 4-point designs for all negative and zero intercept parameters of the binary two-variable logistic model with no interaction. The results are extended to the construction of D-optimal designs on a rectangular design space and illustrated by means of two examples of which one is a real example taken from the literature.     

On representing maximin efficient designs by Taylor series

This paper considers exponential and rational regression models that are nonlinear in some parameters. Recently, locally D-optimal designs for such models were investigated in [Melas, V. B., 2005. On the functional approach to optimal designs for nonlinear models. J. Statist. Plann. Inference 132, 93–116] based upon a functional approach. In this article a similar method is applied to construct maximin efficient D-optimal designs. This approach allows one to represent the support points of the designs by Taylor series, which gives us the opportunity to construct the designs by hand using tables of the coefficients of the series. Such tables are provided here for models with two nonlinear parameters. Furthermore, the recurrent formulas for constructing the tables for arbitrary numbers of parameters are introduced.     

Computing A-optimal Designs for Weighted Polynomial Regression by Taylor Expansion

This article is concerned with the problem of constructing A-optimal design for polynomial regression with analytic weight function on the interval [m ? a, m + a], m, a > 0. It is shown that the structure of the optimal design depends on a and weight function only, as a close to 0. Moreover, if the weight function is an analytic function a, then a scaled version of optimal support points, and weights are analytic functions of a at a = 0. We make use of a Taylor expansion to provide a recursive procedure for calculating the A-optimal designs. Examples are presented to illustrate the procedures for computing the optimal designs.