Efficient estimation and correction of selection-induced bias with order statistics

IF 1.6 2区 数学 Q2 COMPUTER SCIENCE, THEORY & METHODS
Yann McLatchie, Aki Vehtari
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Abstract

Model selection aims to identify a sufficiently well performing model that is possibly simpler than the most complex model among a pool of candidates. However, the decision-making process itself can inadvertently introduce non-negligible bias when the cross-validation estimates of predictive performance are marred by excessive noise. In finite data regimes, cross-validated estimates can encourage the statistician to select one model over another when it is not actually better for future data. While this bias remains negligible in the case of few models, when the pool of candidates grows, and model selection decisions are compounded (as in step-wise selection), the expected magnitude of selection-induced bias is likely to grow too. This paper introduces an efficient approach to estimate and correct selection-induced bias based on order statistics. Numerical experiments demonstrate the reliability of our approach in estimating both selection-induced bias and over-fitting along compounded model selection decisions, with specific application to forward search. This work represents a light-weight alternative to more computationally expensive approaches to correcting selection-induced bias, such as nested cross-validation and the bootstrap. Our approach rests on several theoretic assumptions, and we provide a diagnostic to help understand when these may not be valid and when to fall back on safer, albeit more computationally expensive approaches. The accompanying code facilitates its practical implementation and fosters further exploration in this area.

Abstract Image

利用阶次统计有效估计和修正选择诱导偏差
模型选择的目的是找出一个性能足够好的模型,它可能比候选模型库中最复杂的模型更简单。然而,当预测性能的交叉验证估计值受到过多噪声的影响时,决策过程本身可能会无意中引入不可忽略的偏差。在有限数据环境中,交叉验证估计值会鼓励统计学家选择一个模型而不是另一个模型,而实际上这个模型对未来数据并没有更好的预测效果。虽然在模型数量较少的情况下,这种偏差仍然可以忽略不计,但当候选模型库不断扩大,模型选择决策不断复合(如逐步选择)时,由选择引起的偏差的预期幅度也可能随之增大。本文介绍了一种基于阶次统计估计和纠正选择诱导偏差的有效方法。数值实验证明了我们的方法在估计复合模型选择决策的选择诱导偏差和过拟合方面的可靠性,并具体应用于前向搜索。这项工作是一种轻量级方法,可替代计算成本较高的方法来纠正选择诱导偏差,如嵌套交叉验证和自举法。我们的方法建立在几个理论假设的基础上,我们提供了一种诊断方法,以帮助理解这些假设何时可能无效,以及何时应退而求其次采用更安全、但计算成本更高的方法。随附的代码有助于该方法的实际应用,并促进该领域的进一步探索。
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来源期刊
Statistics and Computing
Statistics and Computing 数学-计算机:理论方法
CiteScore
3.20
自引率
4.50%
发文量
93
审稿时长
6-12 weeks
期刊介绍: Statistics and Computing is a bi-monthly refereed journal which publishes papers covering the range of the interface between the statistical and computing sciences. In particular, it addresses the use of statistical concepts in computing science, for example in machine learning, computer vision and data analytics, as well as the use of computers in data modelling, prediction and analysis. Specific topics which are covered include: techniques for evaluating analytically intractable problems such as bootstrap resampling, Markov chain Monte Carlo, sequential Monte Carlo, approximate Bayesian computation, search and optimization methods, stochastic simulation and Monte Carlo, graphics, computer environments, statistical approaches to software errors, information retrieval, machine learning, statistics of databases and database technology, huge data sets and big data analytics, computer algebra, graphical models, image processing, tomography, inverse problems and uncertainty quantification. In addition, the journal contains original research reports, authoritative review papers, discussed papers, and occasional special issues on particular topics or carrying proceedings of relevant conferences. Statistics and Computing also publishes book review and software review sections.
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