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 Uncertainty


Reinforced Few-Shot Acquisition Function Learning for Bayesian Optimization

arXiv.org Machine Learning

Bayesian optimization (BO) conventionally relies on handcrafted acquisition functions (AFs) to sequentially determine the sample points. However, it has been widely observed in practice that the best-performing AF in terms of regret can vary significantly under different types of black-box functions. It has remained a challenge to design one AF that can attain the best performance over a wide variety of black-box functions. This paper aims to attack this challenge through the perspective of reinforced few-shot AF learning (FSAF). Specifically, we first connect the notion of AFs with Q-functions and view a deep Q-network (DQN) as a surrogate differentiable AF. While it serves as a natural idea to combine DQN and an existing few-shot learning method, we identify that such a direct combination does not perform well due to severe overfitting, which is particularly critical in BO due to the need of a versatile sampling policy. To address this, we present a Bayesian variant of DQN with the following three features: (i) It learns a distribution of Q-networks as AFs based on the Kullback-Leibler regularization framework. This inherently provides the uncertainty required in sampling for BO and mitigates overfitting. (ii) For the prior of the Bayesian DQN, we propose to use a demo policy induced by an off-the-shelf AF for better training stability. (iii) On the meta-level, we leverage the meta-loss of Bayesian model-agnostic meta-learning, which serves as a natural companion to the proposed FSAF. Moreover, with the proper design of the Q-networks, FSAF is general-purpose in that it is agnostic to the dimension and the cardinality of the input domain. Through extensive experiments, we demonstrate that the FSAF achieves comparable or better regrets than the state-of-the-art benchmarks on a wide variety of synthetic and real-world test functions.


Marginalizable Density Models

arXiv.org Machine Learning

Probability density models based on deep networks have achieved remarkable success in modeling complex high-dimensional datasets. However, unlike kernel density estimators, modern neural models do not yield marginals or conditionals in closed form, as these quantities require the evaluation of seldom tractable integrals. In this work, we present the marginalizable density model approximator (MDMA), a novel deep network architecture which provides closed form expressions for the probabilities, marginals and conditionals of any subset of the variables. The MDMA learns deep scalar representations for each individual variable and combines them via learned hierarchical tensor decompositions into a tractable yet expressive CDF, from which marginals and conditional densities are easily obtained. We illustrate the advantage of exact marginalizability in several tasks that are out of reach of previous deep network-based density estimation models, such as estimating mutual information between arbitrary subsets of variables, inferring causality by testing for conditional independence, and inference with missing data without the need for data imputation, outperforming state-of-the-art models on these tasks. The model also allows for parallelized sampling with only a logarithmic dependence of the time complexity on the number of variables.


Learning from Multiple Noisy Partial Labelers

arXiv.org Machine Learning

Programmatic weak supervision creates models without hand-labeled training data by combining the outputs of noisy, user-written rules and other heuristic labelers. Existing frameworks make the restrictive assumption that labelers output a single class label. Enabling users to create partial labelers that output subsets of possible class labels would greatly expand the expressivity of programmatic weak supervision. We introduce this capability by defining a probabilistic generative model that can estimate the underlying accuracies of multiple noisy partial labelers without ground truth labels. We prove that this class of models is generically identifiable up to label swapping under mild conditions. We also show how to scale up learning to 100k examples in one minute, a 300X speed up compared to a naive implementation. We evaluate our framework on three text classification and six object classification tasks. On text tasks, adding partial labels increases average accuracy by 9.6 percentage points. On image tasks, we show that partial labels allow us to approach some zero-shot object classification problems with programmatic weak supervision by using class attributes as partial labelers. Our framework is able to achieve accuracy comparable to recent embedding-based zero-shot learning methods using only pre-trained attribute detectors


Adaptive transfer learning

arXiv.org Machine Learning

In transfer learning, we wish to make inference about a target population when we have access to data both from the distribution itself, and from a different but related source distribution. We introduce a flexible framework for transfer learning in the context of binary classification, allowing for covariate-dependent relationships between the source and target distributions that are not required to preserve the Bayes decision boundary. Our main contributions are to derive the minimax optimal rates of convergence (up to poly-logarithmic factors) in this problem, and show that the optimal rate can be achieved by an algorithm that adapts to key aspects of the unknown transfer relationship, as well as the smoothness and tail parameters of our distributional classes. This optimal rate turns out to have several regimes, depending on the interplay between the relative sample sizes and the strength of the transfer relationship, and our algorithm achieves optimality by careful, decision tree-based calibration of local nearest-neighbour procedures.


Conditional Deep Inverse Rosenblatt Transports

arXiv.org Machine Learning

We present a novel offline-online method to mitigate the computational burden of the characterization of conditional beliefs in statistical learning. In the offline phase, the proposed method learns the joint law of the belief random variables and the observational random variables in the tensor-train (TT) format. In the online phase, it utilizes the resulting order-preserving conditional transport map to issue real-time characterization of the conditional beliefs given new observed information. Compared with the state-of-the-art normalizing flows techniques, the proposed method relies on function approximation and is equipped with thorough performance analysis. This also allows us to further extend the capability of transport maps in challenging problems with high-dimensional observations and high-dimensional belief variables. On the one hand, we present novel heuristics to reorder and/or reparametrize the variables to enhance the approximation power of TT. On the other, we integrate the TT-based transport maps and the parameter reordering/reparametrization into layered compositions to further improve the performance of the resulting transport maps. We demonstrate the efficiency of the proposed method on various statistical learning tasks in ordinary differential equations (ODEs) and partial differential equations (PDEs).


Linear Convergence of Entropy-Regularized Natural Policy Gradient with Linear Function Approximation

arXiv.org Machine Learning

Natural policy gradient (NPG) methods with function approximation achieve impressive empirical success in reinforcement learning problems with large state-action spaces. However, theoretical understanding of their convergence behaviors remains limited in the function approximation setting. In this paper, we perform a finite-time analysis of NPG with linear function approximation and softmax parameterization, and prove for the first time that widely used entropy regularization method, which encourages exploration, leads to linear convergence rate. We adopt a Lyapunov drift analysis to prove the convergence results and explain the effectiveness of entropy regularization in improving the convergence rates.


Recommending Multiple Criteria Decision Analysis Methods with A New Taxonomy-based Decision Support System

arXiv.org Artificial Intelligence

We present the Multiple Criteria Decision Analysis Methods Selection Software (MCDA-MSS). This decision support system helps analysts answering a recurring question in decision science: Which is the most suitable Multiple Criteria Decision Analysis method (or a subset of MCDA methods) that should be used for a given Decision-Making Problem (DMP)?. The MCDA-MSS includes guidance to lead decision-making processes and choose among an extensive collection (over 200) of MCDA methods. These are assessed according to an original comprehensive set of problem characteristics. The accounted features concern problem formulation, preference elicitation and types of preference information, desired features of a preference model, and construction of the decision recommendation. The applicability of the MCDA-MSS has been tested on several case studies. The MCDA-MSS includes the capabilities of (i) covering from very simple to very complex DMPs, (ii) offering recommendations for DMPs that do not match any method from the collection, (iii) helping analysts prioritize efforts for reducing gaps in the description of the DMPs, and (iv) unveiling methodological mistakes that occur in the selection of the methods. A community-wide initiative involving experts in MCDA methodology, analysts using these methods, and decision-makers receiving decision recommendations will contribute to expansion of the MCDA-MSS.


Dynamic Instance-Wise Classification in Correlated Feature Spaces

arXiv.org Artificial Intelligence

In a typical supervised machine learning setting, the predictions on all test instances are based on a common subset of features discovered during model training. However, using a different subset of features that is most informative for each test instance individually may not only improve prediction accuracy, but also the overall interpretability of the model. At the same time, feature selection methods for classification have been known to be the most effective when many features are irrelevant and/or uncorrelated. In fact, feature selection ignoring correlations between features can lead to poor classification performance. In this work, a Bayesian network is utilized to model feature dependencies. Using the dependency network, a new method is proposed that sequentially selects the best feature to evaluate for each test instance individually, and stops the selection process to make a prediction once it determines that no further improvement can be achieved with respect to classification accuracy. The optimum number of features to acquire and the optimum classification strategy are derived for each test instance. The theoretical properties of the optimum solution are analyzed, and a new algorithm is proposed that takes advantage of these properties to implement a robust and scalable solution for high dimensional settings. The effectiveness, generalizability, and scalability of the proposed method is illustrated on a variety of real-world datasets from diverse application domains.


North Carolina COVID-19 Agent-Based Model Framework for Hospitalization Forecasting Overview, Design Concepts, and Details Protocol

arXiv.org Artificial Intelligence

This Overview, Design Concepts, and Details Protocol (ODD) provides a detailed description of an agent-based model (ABM) that was developed to simulate hospitalizations during the COVID-19 pandemic. Using the descriptions of submodels, provided parameters, and the links to data sources, modelers will be able to replicate the creation and results of this model.


Towards interval uncertainty propagation control in bivariate aggregation processes and the introduction of width-limited interval-valued overlap functions

arXiv.org Artificial Intelligence

Overlap functions are a class of aggregation functions that measure the overlapping degree between two values. Interval-valued overlap functions were defined as an extension to express the overlapping of interval-valued data, and they have been usually applied when there is uncertainty regarding the assignment of membership degrees. The choice of a total order for intervals can be significant, which motivated the recent developments on interval-valued aggregation functions and interval-valued overlap functions that are increasing to a given admissible order, that is, a total order that refines the usual partial order for intervals. Also, width preservation has been considered on these recent works, in an intent to avoid the uncertainty increase and guarantee the information quality, but no deeper study was made regarding the relation between the widths of the input intervals and the output interval, when applying interval-valued functions, or how one can control such uncertainty propagation based on this relation. Thus, in this paper we: (i) introduce and develop the concepts of width-limited interval-valued functions and width limiting functions, presenting a theoretical approach to analyze the relation between the widths of the input and output intervals of bivariate interval-valued functions, with special attention to interval-valued aggregation functions; (ii) introduce the concept of $(a,b)$-ultramodular aggregation functions, a less restrictive extension of one-dimension convexity for bivariate aggregation functions, which have an important predictable behaviour with respect to the width when extended to the interval-valued context; (iii) define width-limited interval-valued overlap functions, taking into account a function that controls the width of the output interval; (iv) present and compare three construction methods for these width-limited interval-valued overlap functions.