Annotating the right data for training deep neural networks is an important challenge. Active learning using uncertainty estimates from Bayesian Neural Networks (BNNs) could provide an effective solution to this. Despite being theoretically principled, BNNs require approximations to be applied to large-scale problems, and have not been used widely by practitioners. In this paper, we introduce Deep Probabilistic Ensembles (DPEs), a scalable technique that uses a regularized ensemble to approximate a deep BNN. We conduct a series of active learning experiments to evaluate DPEs on classification with the CIFAR-10, CIFAR-100 and ImageNet datasets, and semantic segmentation with the BDD100k dataset. Our models consistently outperform baselines and previously published methods, requiring significantly less training data to achieve competitive performances.

The utility of the Čech complex is ensured by the nerve theorem: if the elements of were sampled from a topological space M, under certain sampling assumptions the Čech complex approximates the topology of M. In particular, the 1-skeleton (i.e. the set of 0-and 1-simplices) of the Čech complex is a graph of the type considered in manifold learning approaches. Since computing triple and higher-order intersections among balls is computationally costly, the Vietoris-Rips complex (defined as the clique complex of the 1-skeleton of a Čech complex) is often used in practice as an approximation to the Čech complex (6). Additionally, Uniform Manifold Approximation and Projection (UMAP) (7) and Mapper (8) can be used to generate reduced abstract simplicial complex representations of the data. Figure 2. Čech complex constructed from intersections of fixed-radius balls centered at the elements of the point cloud . In this example, the elements of are ordered according to the horizontal coordinate.

Reviews spams are prevalent in e-commerce to manipulate product ranking and customers decisions maliciously. While spams generated based on simple spamming strategy can be detected effectively, hardened spammers can evade regular detectors via more advanced spamming strategies. Previous work gave more attention to evasion against text and graph-based detectors, but evasions against behavior-based detectors are largely ignored, leading to vulnerabilities in spam detection systems. Since real evasion data are scarce, we first propose EMERAL (Evasion via Maximum Entropy and Rating sAmpLing) to generate evasive spams to certain existing detectors. EMERAL can simulate spammers with different goals and levels of knowledge about the detectors, targeting at different stages of the life cycle of target products. We show that in the evasion-defense dynamic, only a few evasion types are meaningful to the spammers, and any spammer will not be able to evade too many detection signals at the same time. We reveal that some evasions are quite insidious and can fail all detection signals. We then propose DETER (Defense via Evasion generaTion using EmeRal), based on model re-training on diverse evasive samples generated by EMERAL. Experiments confirm that DETER is more accurate in detecting both suspicious time window and individual spamming reviews. In terms of security, DETER is versatile enough to be vaccinated against diverse and unexpected evasions, is agnostic about evasion strategy and can be released without privacy concern.

Given a fixed $n\times d$ matrix $\mathbf{X}$, where $n\gg d$, we study the complexity of sampling from a distribution over all subsets of rows where the probability of a subset is proportional to the squared volume of the parallelopiped spanned by the rows (a.k.a. a determinantal point process). In this task, it is important to minimize the preprocessing cost of the procedure (performed once) as well as the sampling cost (performed repeatedly). To that end, we propose a new determinantal point process algorithm which has the following two properties, both of which are novel: (1) a preprocessing step which runs in time $O(\text{number-of-non-zeros}(\mathbf{X})\cdot\log n)+\text{poly}(d)$, and (2) a sampling step which runs in $\text{poly}(d)$ time, independent of the number of rows $n$. We achieve this by introducing a new regularized determinantal point process (R-DPP), which serves as an intermediate distribution in the sampling procedure by reducing the number of rows from $n$ to $\text{poly}(d)$. Crucially, this intermediate distribution does not distort the probabilities of the target sample. Our key novelty in defining the R-DPP is the use of a Poisson random variable for controlling the probabilities of different subset sizes, leading to new determinantal formulas such as the normalization constant for this distribution. Our algorithm has applications in many diverse areas where determinantal point processes have been used, such as machine learning, stochastic optimization, data summarization and low-rank matrix reconstruction.

The success of modern Artificial Intelligence (AI) technologies depends critically on the ability to learn nonlinear functional dependencies from large, high dimensional data sets. Despite recent high-profile successes, empirical evidence indicates that the high predictive performance is often paired with low robustness, making AI systems potentially vulnerable to adversarial attacks. In this report, we provide a simple intuitive argument suggesting that high performance and vulnerability are intrinsically coupled, and largely dependent on the geometry of typical, high-dimensional data sets. Our work highlights a major potential pitfall of modern AI systems, and suggests practical research directions to ameliorate the problem. Artificial Intelligence (AI) is colonising all areas of human endeavour, and its impact is widely predicted to grow exponentially in the next decades.

Data collection is a major bottleneck in machine learning and an active research topic in multiple communities. There are largely two reasons data collection has recently become a critical issue. First, as machine learning is becoming more widely-used, we are seeing new applications that do not necessarily have enough labeled data. Second, unlike traditional machine learning where feature engineering is the bottleneck, deep learning techniques automatically generate features, but instead require large amounts of labeled data. Interestingly, recent research in data collection comes not only from the machine learning, natural language, and computer vision communities, but also from the data management community due to the importance of handling large amounts of data. In this survey, we perform a comprehensive study of data collection from a data management point of view. Data collection largely consists of data acquisition, data labeling, and improvement of existing data or models. We provide a research landscape of these operations, provide guidelines on which technique to use when, and identify interesting research challenges. The integration of machine learning and data management for data collection is part of a larger trend of Big data and Artificial Intelligence (AI) integration and opens many opportunities for new research.

The key to success in machine learning (ML) is the use of effective data representations. Traditionally, data representations were hand-crafted. Recently it has been demonstrated that, given sufficient data, deep neural networks can learn effective implicit representations from simple input representations. However, for most scientific problems, the use of deep learning is not appropriate as the amount of available data is limited, and/or the output models must be explainable. Nevertheless, many scientific problems do have significant amounts of data available on related tasks, which makes them amenable to multi-task learning, i.e. learning many related problems simultaneously. Here we propose a novel and general representation learning approach for multi-task learning that works successfully with small amounts of data. The fundamental new idea is to transform an input intrinsic data representation (i.e., handcrafted features), to an extrinsic representation based on what a pre-trained set of models predict about the examples. This transformation has the dual advantages of producing significantly more accurate predictions, and providing explainable models. To demonstrate the utility of this transformative learning approach, we have applied it to three real-world scientific problems: drug-design (quantitative structure activity relationship learning), predicting human gene expression (across different tissue types and drug treatments), and meta-learning for machine learning (predicting which machine learning methods work best for a given problem). In all three problems, transformative machine learning significantly outperforms the best intrinsic representation.

We derive upper bounds on the generalization error of learning algorithms based on their \emph{algorithmic transport cost}: the expected Wasserstein distance between the output hypothesis and the output hypothesis conditioned on an input example. The bounds provide a novel approach to study the generalization of learning algorithms from an optimal transport view and impose less constraints on the loss function, such as sub-gaussian or bounded. We further provide several upper bounds on the algorithmic transport cost in terms of total variation distance, relative entropy (or KL-divergence), and VC dimension, thus further bridging optimal transport theory and information theory with statistical learning theory. Moreover, we also study different conditions for loss functions under which the generalization error of a learning algorithm can be upper bounded by different probability metrics between distributions relating to the output hypothesis and/or the input data. Finally, under our established framework, we analyze the generalization in deep learning and conclude that the generalization error in deep neural networks (DNNs) decreases exponentially to zero as the number of layers increases. Our analyses of generalization error in deep learning mainly exploit the hierarchical structure in DNNs and the contraction property of $f$-divergence, which may be of independent interest in analyzing other learning models with hierarchical structure.

Four-dimensional scanning transmission electron microscopy (4D-STEM) of local atomic diffraction patterns is emerging as a powerful technique for probing intricate details of atomic structure and atomic electric fields. However, efficient processing and interpretation of large volumes of data remain challenging, especially for two-dimensional or light materials because the diffraction signal recorded on the pixelated arrays is weak. Here we employ data-driven manifold leaning approaches for straightforward visualization and exploration analysis of the 4D-STEM datasets, distilling real-space neighboring effects on atomically resolved deflection patterns from single-layer graphene, with single dopant atoms, as recorded on a pixelated detector. These extracted patterns relate to both individual atom sites and sublattice structures, effectively discriminating single dopant anomalies via multi-mode views. We believe manifold learning analysis will accelerate physics discoveries coupled between data-rich imaging mechanisms and materials such as ferroelectric, topological spin and van der Waals heterostructures.

We propose a method to classify cardiac pathology based on a novel approach to extract image derived features to characterize the shape and motion of the heart. An original semi-supervised learning procedure, which makes efficient use of a large amount of non-segmented images and a small amount of images segmented manually by experts, is developed to generate pixel-wise apparent flow between two time points of a 2D+t cine MRI image sequence. Combining the apparent flow maps and cardiac segmentation masks, we obtain a local apparent flow corresponding to the 2D motion of myocardium and ventricular cavities. This leads to the generation of time series of the radius and thickness of myocardial segments to represent cardiac motion. These time series of motion features are reliable and explainable characteristics of pathological cardiac motion. Furthermore, they are combined with shape-related features to classify cardiac pathologies. Using only nine feature values as input, we propose an explainable, simple and flexible model for pathology classification. On ACDC training set and testing set, the model achieves 95% and 94% respectively as classification accuracy. Its performance is hence comparable to that of the state-of-the-art. Comparison with various other models is performed to outline some advantages of our model.