Data-centric Prediction Explanation via Kernelized Stein Discrepancy

Existing example-based prediction explanation methods often bridge test and training data points through the model's parameters or latent representations. While these methods offer clues to the causes of model predictions, they often exhibit innate shortcomings, such as incurring significant computational overhead or producing coarse-grained explanations. This paper presents a Highly-precise and Data-centric Explanation (HD-Explain), a straightforward prediction explanation method exploiting properties of Kernelized Stein Discrepancy (KSD). Specifically, the KSD uniquely defines a parameterized kernel function for a trained model that encodes model-dependent data correlation. By leveraging the kernel function, one can identify training samples that provide the best predictive support to a test point efficiently. We conducted thorough analyses and experiments across multiple classification domains, where we show that HD-Explain outperforms existing methods from various aspects, including 1) preciseness (fine-grained explanation), 2) consistency, and 3) computation efficiency, leading to a surprisingly simple, effective, and robust prediction explanation solution.

Within-basket Recommendation via Neural Pattern Associator

Within-basket recommendation (WBR) refers to the task of recommending items to the end of completing a non-empty shopping basket during a shopping session. While the latest innovations in this space demonstrate remarkable performance improvement on benchmark datasets, they often overlook the complexity of user behaviors in practice, such as 1) co-existence of multiple shopping intentions, 2) multi-granularity of such intentions, and 3) interleaving behavior (switching intentions) in a shopping session. This paper presents Neural Pattern Associator (NPA), a deep item-association-mining model that explicitly models the aforementioned factors. Specifically, inspired by vector quantization, the NPA model learns to encode common user intentions (or item-combination patterns) as quantized representations (a.k.a. codebook), which permits identification of users's shopping intentions via attention-driven lookup during the reasoning phase. This yields coherent and self-interpretable recommendations. We evaluated the proposed NPA model across multiple extensive datasets, encompassing the domains of grocery e-commerce (shopping basket completion) and music (playlist extension), where our quantitative evaluations show that the NPA model significantly outperforms a wide range of existing WBR solutions, reflecting the benefit of explicitly modeling complex user intentions.

Self-supervised Representation Learning From Random Data Projectors

Self-supervised representation learning~(SSRL) has advanced considerably by exploiting the transformation invariance assumption under artificially designed data augmentations. While augmentation-based SSRL algorithms push the boundaries of performance in computer vision and natural language processing, they are often not directly applicable to other data modalities, and can conflict with application-specific data augmentation constraints. This paper presents an SSRL approach that can be applied to any data modality and network architecture because it does not rely on augmentations or masking. Specifically, we show that high-quality data representations can be learned by reconstructing random data projections. We evaluate the proposed approach on a wide range of representation learning tasks that span diverse modalities and real-world applications. We show that it outperforms multiple state-of-the-art SSRL baselines. Due to its wide applicability and strong empirical results, we argue that learning from randomness is a fruitful research direction worthy of attention and further study.

fAux: Testing Individual Fairness via Gradient Alignment

Machine learning models are vulnerable to biases that result in unfair treatment of individuals from different populations. Recent work that aims to test a model's fairness at the individual level either relies on domain knowledge to choose metrics, or on input transformations that risk generating out-of-domain samples. We describe a new approach for testing individual fairness that does not have either requirement. We propose a novel criterion for evaluating individual fairness and develop a practical testing method based on this criterion which we call fAux (pronounced fox). This is based on comparing the derivatives of the predictions of the model to be tested with those of an auxiliary model, which predicts the protected variable from the observed data. We show that the proposed method effectively identifies discrimination on both synthetic and real-world datasets, and has quantitative and qualitative advantages over contemporary methods.

Scalable Whitebox Attacks on Tree-based Models

Adversarial robustness is one of the essential safety criteria for guaranteeing the reliability of machine learning models. While various adversarial robustness testing approaches were introduced in the last decade, we note that most of them are incompatible with non-differentiable models such as tree ensembles. Since tree ensembles are widely used in industry, this reveals a crucial gap between adversarial robustness research and practical applications. This paper proposes a novel whitebox adversarial robustness testing approach for tree ensemble models. Concretely, the proposed approach smooths the tree ensembles through temperature controlled sigmoid functions, which enables gradient descent-based adversarial attacks. By leveraging sampling and the log-derivative trick, the proposed approach can scale up to testing tasks that were previously unmanageable. We compare the approach against both random perturbations and blackbox approaches on multiple public datasets (and corresponding models). Our results show that the proposed method can 1) successfully reveal the adversarial vulnerability of tree ensemble models without causing computational pressure for testing and 2) flexibly balance the search performance and time complexity to meet various testing criteria.

PUMA: Performance Unchanged Model Augmentation for Training Data Removal

Preserving the performance of a trained model while removing unique characteristics of marked training data points is challenging. Recent research usually suggests retraining a model from scratch with remaining training data or refining the model by reverting the model optimization on the marked data points. Unfortunately, aside from their computational inefficiency, those approaches inevitably hurt the resulting model's generalization ability since they remove not only unique characteristics but also discard shared (and possibly contributive) information. To address the performance degradation problem, this paper presents a novel approach called Performance Unchanged Model Augmentation~(PUMA). The proposed PUMA framework explicitly models the influence of each training data point on the model's generalization ability with respect to various performance criteria. It then complements the negative impact of removing marked data by reweighting the remaining data optimally. To demonstrate the effectiveness of the PUMA framework, we compared it with multiple state-of-the-art data removal techniques in the experiments, where we show the PUMA can effectively and efficiently remove the unique characteristics of marked training data without retraining the model that can 1) fool a membership attack, and 2) resist performance degradation. In addition, as PUMA estimates the data importance during its operation, we show it could serve to debug mislabelled data points more efficiently than existing approaches.

Multi-axis Attentive Prediction for Sparse EventData: An Application to Crime Prediction

Spatiotemporal prediction of event data is a challenging task with a long history of research. While recent work in spatiotemporal prediction has leveraged deep sequential models that substantially improve over classical approaches, these models are prone to overfitting when the observation is extremely sparse, as in the task of crime event prediction. To overcome these sparsity issues, we present Multi-axis Attentive Prediction for Sparse Event Data (MAPSED). We propose a purely attentional approach to extract both short-term dynamics and long-term semantics of event propagation through two observation angles. Unlike existing temporal prediction models that propagate latent information primarily along the temporal dimension, the MAPSED simultaneously operates over all axes (time, 2D space, event type) of the embedded data tensor. We additionally introduce a novel Frobenius norm-based contrastive learning objective to improve latent representational generalization.Empirically, we validate MAPSED on two publicly accessible urban crime datasets for spatiotemporal sparse event prediction, where MAPSED outperforms both classical and state-of-the-art deep learning models. The proposed contrastive learning objective significantly enhances the MAPSED's ability to capture the semantics and dynamics of the events, resulting in better generalization ability to combat sparse observations.

Attentive Autoencoders for Multifaceted Preference Learning in One-class Collaborative Filtering

Most existing One-Class Collaborative Filtering (OC-CF) algorithms estimate a user's preference as a latent vector by encoding their historical interactions. However, users often show diverse interests, which significantly increases the learning difficulty. In order to capture multifaceted user preferences, existing recommender systems either increase the encoding complexity or extend the latent representation dimension. Unfortunately, these changes inevitably lead to increased training difficulty and exacerbate scalability issues. In this paper, we propose a novel and efficient CF framework called Attentive Multi-modal AutoRec (AMA) that explicitly tracks multiple facets of user preferences. Specifically, we extend the Autoencoding-based recommender AutoRec to learn user preferences with multi-modal latent representations, where each mode captures one facet of a user's preferences. By leveraging the attention mechanism, each observed interaction can have different contributions to the preference facets. Through extensive experiments on three real-world datasets, we show that AMA is competitive with state-of-the-art models under the OC-CF setting. Also, we demonstrate how the proposed model improves interpretability by providing explanations using the attention mechanism.

Scalable Nonlinear Planning with Deep Neural Network Learned Transition Models

In many real-world planning problems with factored, mixed discrete and continuous state and action spaces such as Reservoir Control, Heating Ventilation, and Air Conditioning, and Navigation domains, it is difficult to obtain a model of the complex nonlinear dynamics that govern state evolution. However, the ubiquity of modern sensors allows us to collect large quantities of data from each of these complex systems and build accurate, nonlinear deep neural network models of their state transitions. But there remains one major problem for the task of control -- how can we plan with deep network learned transition models without resorting to Monte Carlo Tree Search and other black-box transition model techniques that ignore model structure and do not easily extend to mixed discrete and continuous domains? In this paper, we introduce two types of nonlinear planning methods that can leverage deep neural network learned transition models: Hybrid Deep MILP Planner (HD-MILP-Plan) and Tensorflow Planner (TF-Plan). In HD-MILP-Plan, we make the critical observation that the Rectified Linear Unit transfer function for deep networks not only allows faster convergence of model learning, but also permits a direct compilation of the deep network transition model to a Mixed-Integer Linear Program encoding. Further, we identify deep network specific optimizations for HD-MILP-Plan that improve performance over a base encoding and show that we can plan optimally with respect to the learned deep networks. In TF-Plan, we take advantage of the efficiency of auto-differentiation tools and GPU-based computation where we encode a subclass of purely continuous planning problems as Recurrent Neural Networks and directly optimize the actions through backpropagation. We compare both planners and show that TF-Plan is able to approximate the optimal plans found by HD-MILP-Plan in less computation time...

Conditional Inference in Pre-trained Variational Autoencoders via Cross-coding

Variational Autoencoders (VAEs) are a popular generative model, but one in which conditional inference can be challenging. If the decomposition into query and evidence variables is fixed, conditional VAEs provide an attractive solution. To support arbitrary queries, one is generally reduced to Markov Chain Monte Carlo sampling methods that can suffer from long mixing times. In this paper, we propose an idea we term cross-coding to approximate the distribution over the latent variables after conditioning on an evidence assignment to some subset of the variables. This allows generating query samples without retraining the full VAE. We experimentally evaluate three variations of cross-coding showing that (i) they can be quickly optimized for different decompositions of evidence and query and (ii) they quantitatively and qualitatively outperform Hamiltonian Monte Carlo.