General foundations of high-dimensional model representations

被引:731
作者
Rabitz, H [1 ]
Alis, ÖF
机构
[1] Princeton Univ, Dept Chem, Princeton, NJ 08544 USA
[2] Princeton Univ, Program Appl & Computat Math, Princeton, NJ 08544 USA
关键词
D O I
10.1023/A:1019188517934
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
A family of multivariate representations is introduced to capture the input-output relationships of high-dimensional physical systems with many input variables. A systematic mapping procedure between the inputs and outputs is prescribed to reveal the hierarchy of correlations amongst the input variables. It is argued that for most well-defined physical systems, only relatively low-order correlations of the input variables are expected to have an impact upon the output. The high-dimensional model representations (HDMR) utilize this property to present an exact hierarchical representation of the physical system. At each new level of HDMR, higher-order correlated effects of the input variables are introduced. Tests on several systems indicate that the few lowest-order terms are often sufficient to represent the model in equivalent form to good accuracy. The input variables may be either finite-dimensional (i.e., a vector of parameters chosen from the Euclidean space R-n) or may be infinite-dimensional as in the function space C-n[0,1]. Each hierarchical level of HDMR is obtained by applying a suitable projection operator to the output function and each of these levels are orthogonal to each other with respect to an appropriately defined inner product. A family of HDMRs may be generated with each having distinct character by the use of different choices of projection operators. Two types of HDMRs are illustrated in the paper: ANOVA-HDMR is the same as the analysis of variance (ANOVA) decomposition used in statistics. Another cut-HDMR will be shown to be computationally more efficient than the ANOVA decomposition. Application of the HDMR tools can dramatically reduce the computational effort needed in representing the input-output relationships of a physical system. In addition, the hierarchy of identified correlation functions can provide valuable insight into the model structure. The notion of a model in the paper also encompasses input-output relationships developed with laboratory experiments, and the HDMR concepts are equally applicable in this domain. HDMRs can be classified as non-regressive, non-parametric learning networks. Selected applications of the HDMR concept are presented along with a discussion of its general utility.
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页码:197 / 233
页数:37
相关论文
共 35 条
[1]  
CHEN L, 1997, IN PRESS J GEOPHYS R
[2]   SENSITIVITY ANALYSIS OF THE ATMOSPHERIC REACTION DIFFUSION EQUATION [J].
CHO, SY ;
CARMICHAEL, GR ;
RABITZ, H .
ATMOSPHERIC ENVIRONMENT, 1987, 21 (12) :2589-2598
[3]   ON NONLINEAR FUNCTIONS OF LINEAR-COMBINATIONS [J].
DIACONIS, P ;
SHAHSHAHANI, M .
SIAM JOURNAL ON SCIENTIFIC AND STATISTICAL COMPUTING, 1984, 5 (01) :175-191
[4]   IMPACT OF HETEROGENEOUS REACTIONS ON STRATOSPHERIC CHEMISTRY OF THE ARCTIC [J].
DOUGLASS, AR ;
STOLARSKI, RS .
GEOPHYSICAL RESEARCH LETTERS, 1989, 16 (02) :131-134
[5]   THE JACKKNIFE ESTIMATE OF VARIANCE [J].
EFRON, B ;
STEIN, C .
ANNALS OF STATISTICS, 1981, 9 (03) :586-596
[6]  
Egorov A.D., 1993, Functional Integrals: Approximate Evaluationand Applications
[7]   PROJECTION PURSUIT REGRESSION [J].
FRIEDMAN, JH ;
STUETZLE, W .
JOURNAL OF THE AMERICAN STATISTICAL ASSOCIATION, 1981, 76 (376) :817-823
[8]   Representation Properties of Networks: Kolmogorov's Theorem Is Irrelevant [J].
Girosi, Federico ;
Poggio, Tomaso .
NEURAL COMPUTATION, 1989, 1 (04) :465-469
[9]  
Gordon W. J., 1969, Proceedings of a symposium on approximation with special emphasis on spline functions, P223
[10]  
Hill T. L., 1987, Statistical Mechanics: Principles and Selected Applications