One of the challenges in deploying a machine learning model is that the model's performance degrades as the operating environment changes. To maintain the performance, streaming active learning is used, in which the model is retrained by adding a newly annotated sample to the training dataset if the prediction of the sample is not certain enough. Although many streaming active learning methods have been proposed for classification, few efforts have been made for regression problems, which are often handled in the industrial field. In this paper, we propose to use the regression-via-classification framework for streaming active learning for regression. Regression-via-classification transforms regression problems into classification problems so that streaming active learning methods proposed for classification problems can be applied directly to regression problems. Experimental validation on four real data sets shows that the proposed method can perform regression with higher accuracy at the same annotation cost.
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Correlation clustering is a powerful unsupervised learning paradigm that supports positive and negative similarities. In this paper, we assume the similarities are not known in advance. Instead, we employ active learning to iteratively query similarities in a cost-efficient way. In particular, we develop three effective acquisition functions to be used in this setting. One is based on the notion of inconsistency (i.e., when similarities violate the transitive property). The remaining two are based on information-theoretic quantities, i.e., entropy and information gain.
Variable importance plays a pivotal role in interpretable machine learning as it helps measure the impact of factors on the output of the prediction model. Model agnostic methods based on the generation of "null" features via permutation (or related approaches) can be applied. Such analysis is often utilized in pharmaceutical applications due to its ability to interpret black-box models, including tree-based ensembles. A major challenge and significant confounder in variable importance estimation however is the presence of between-feature correlation. Recently, several adjustments to marginal permutation utilizing feature knockoffs were proposed to address this issue, such as the variable importance measure known as conditional predictive impact (CPI). Assessment and evaluation of such approaches is the focus of our work. We first present a comprehensive simulation study investigating the impact of feature correlation on the assessment of variable importance. We then theoretically prove the limitation that highly correlated features pose for the CPI through the knockoff construction. While we expect that there is always no correlation between knockoff variables and its corresponding predictor variables, we prove that the correlation increases linearly beyond a certain correlation threshold between the predictor variables. Our findings emphasize the absence of free lunch when dealing with high feature correlation, as well as the necessity of understanding the utility and limitations behind methods in variable importance estimation.
A major challenge in designing efficient statistical supervised learning algorithms is finding representations that perform well not only on available training samples but also on unseen data. While the study of representation learning has spurred much interest, most existing such approaches are heuristic; and very little is known about theoretical generalization guarantees. In this paper, we establish a compressibility framework that allows us to derive upper bounds on the generalization error of a representation learning algorithm in terms of the "Minimum Description Length" (MDL) of the labels or the latent variables (representations). Rather than the mutual information between the encoder's input and the representation, which is often believed to reflect the algorithm's generalization capability in the related literature but in fact, falls short of doing so, our new bounds involve the "multi-letter" relative entropy between the distribution of the representations (or labels) of the training and test sets and a fixed prior. In particular, these new bounds reflect the structure of the encoder and are not vacuous for deterministic algorithms. Our compressibility approach, which is information-theoretic in nature, builds upon that of Blum-Langford for PAC-MDL bounds and introduces two essential ingredients: block-coding and lossy-compression. The latter allows our approach to subsume the so-called geometrical compressibility as a special case. To the best knowledge of the authors, the established generalization bounds are the first of their kind for Information Bottleneck (IB) type encoders and representation learning. Finally, we partly exploit the theoretical results by introducing a new data-dependent prior. Numerical simulations illustrate the advantages of well-chosen such priors over classical priors used in IB.
When facing an unsatisfactory prediction from a machine learning model, users can be interested in investigating the underlying reasons and exploring the potential for reversing the outcome. We ask: To flip the prediction on a test point $x_t$, how to identify the smallest training subset $\mathcal{S}_t$ that we need to relabel? We propose an efficient algorithm to identify and relabel such a subset via an extended influence function for binary classification models with convex loss. We find that relabeling fewer than 2% of the training points can always flip a prediction. This mechanism can serve multiple purposes: (1) providing an approach to challenge a model prediction by altering training points; (2) evaluating model robustness with the cardinality of the subset (i.e., $|\mathcal{S}_t|$); we show that $|\mathcal{S}_t|$ is highly related to the noise ratio in the training set and $|\mathcal{S}_t|$ is correlated with but complementary to predicted probabilities; and (3) revealing training points lead to group attribution bias. To the best of our knowledge, we are the first to investigate identifying and relabeling the minimal training subset required to flip a given prediction.
When training predictive models on data with missing entries, the most widely used and versatile approach is a pipeline technique where we first impute missing entries and then compute predictions. In this paper, we view prediction with missing data as a two-stage adaptive optimization problem and propose a new class of models, adaptive linear regression models, where the regression coefficients adapt to the set of observed features. We show that some adaptive linear regression models are equivalent to learning an imputation rule and a downstream linear regression model simultaneously instead of sequentially. We leverage this joint-impute-then-regress interpretation to generalize our framework to non-linear models. In settings where data is strongly not missing at random, our methods achieve a 2-10% improvement in out-of-sample accuracy.
Automated test generation for web forms has been a longstanding challenge, exacerbated by the intrinsic human-centric design of forms and their complex, device-agnostic structures. We introduce an innovative approach, called FormNexus, for automated web form test generation, which emphasizes deriving semantic insights from individual form elements and relations among them, utilizing textual content, DOM tree structures, and visual proximity. The insights gathered are transformed into a new conceptual graph, the Form Entity Relation Graph (FERG), which offers machine-friendly semantic information extraction. Leveraging LLMs, FormNexus adopts a feedback-driven mechanism for generating and refining input constraints based on real-time form submission responses. The culmination of this approach is a robust set of test cases, each produced by methodically invalidating constraints, ensuring comprehensive testing scenarios for web forms. This work bridges the existing gap in automated web form testing by intertwining the capabilities of LLMs with advanced semantic inference methods. Our evaluation demonstrates that FormNexus combined with GPT-4 achieves 89% coverage in form submission states. This outcome significantly outstrips the performance of the best baseline model by a margin of 25%.
The adaptive processing of structured data is a long-standing research topic in machine learning that investigates how to automatically learn a mapping from a structured input to outputs of various nature. Recently, there has been an increasing interest in the adaptive processing of graphs, which led to the development of different neural network-based methodologies. In this thesis, we take a different route and develop a Bayesian Deep Learning framework for graph learning. The dissertation begins with a review of the principles over which most of the methods in the field are built, followed by a study on graph classification reproducibility issues. We then proceed to bridge the basic ideas of deep learning for graphs with the Bayesian world, by building our deep architectures in an incremental fashion. This framework allows us to consider graphs with discrete and continuous edge features, producing unsupervised embeddings rich enough to reach the state of the art on several classification tasks. Our approach is also amenable to a Bayesian nonparametric extension that automatizes the choice of almost all model's hyper-parameters. Two real-world applications demonstrate the efficacy of deep learning for graphs. The first concerns the prediction of information-theoretic quantities for molecular simulations with supervised neural models. After that, we exploit our Bayesian models to solve a malware-classification task while being robust to intra-procedural code obfuscation techniques. We conclude the dissertation with an attempt to blend the best of the neural and Bayesian worlds together. The resulting hybrid model is able to predict multimodal distributions conditioned on input graphs, with the consequent ability to model stochasticity and uncertainty better than most works. Overall, we aim to provide a Bayesian perspective into the articulated research field of deep learning for graphs.
Data augmentation, the artificial creation of training data for machine learning by transformations, is a widely studied research field across machine learning disciplines. While it is useful for increasing the generalization capabilities of a model, it can also address many other challenges and problems, from overcoming a limited amount of training data over regularizing the objective to limiting the amount data used to protect privacy. Based on a precise description of the goals and applications of data augmentation (C1) and a taxonomy for existing works (C2), this survey is concerned with data augmentation methods for textual classification and aims to achieve a concise and comprehensive overview for researchers and practitioners (C3). Derived from the taxonomy, we divided more than 100 methods into 12 different groupings and provide state-of-the-art references expounding which methods are highly promising (C4). Finally, research perspectives that may constitute a building block for future work are given (C5).
This paper surveys the machine learning literature and presents machine learning as optimization models. Such models can benefit from the advancement of numerical optimization techniques which have already played a distinctive role in several machine learning settings. Particularly, mathematical optimization models are presented for commonly used machine learning approaches for regression, classification, clustering, and deep neural networks as well new emerging applications in machine teaching and empirical model learning. The strengths and the shortcomings of these models are discussed and potential research directions are highlighted.
We advocate the use of implicit fields for learning generative models of shapes and introduce an implicit field decoder for shape generation, aimed at improving the visual quality of the generated shapes. An implicit field assigns a value to each point in 3D space, so that a shape can be extracted as an iso-surface. Our implicit field decoder is trained to perform this assignment by means of a binary classifier. Specifically, it takes a point coordinate, along with a feature vector encoding a shape, and outputs a value which indicates whether the point is outside the shape or not. By replacing conventional decoders by our decoder for representation learning and generative modeling of shapes, we demonstrate superior results for tasks such as shape autoencoding, generation, interpolation, and single-view 3D reconstruction, particularly in terms of visual quality.
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