Deep learning methods have demonstrated outstanding performances on classification and regression tasks on homogeneous data types (e.g., image, audio, and text data). However, tabular data still poses a challenge with classic machine learning approaches being often computationally cheaper and equally effective than increasingly complex deep learning architectures. The challenge arises from the fact that, in tabular data, the correlation among features is weaker than the one from spatial or semantic relationships in images or natural languages, and the dependency structures need to be modeled without any prior information. In this work, we propose a novel deep learning architecture that exploits the data structural organization through topologically constrained network representations to gain spatial information from sparse tabular data. The resulting model leverages the power of convolutions and is centered on a limited number of concepts from network topology to guarantee (i) a data-centric, deterministic building pipeline; (ii) a high level of interpretability over the inference process; and (iii) an adequate room for scalability. We test our model on 18 benchmark datasets against 5 classic machine learning and 3 deep learning models demonstrating that our approach reaches state-of-the-art performances on these challenging datasets. The code to reproduce all our experiments is provided at //github.com/FinancialComputingUCL/HomologicalCNN.
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Structured prediction problems are one of the fundamental tools in machine learning. In order to facilitate algorithm development for their numerical solution, we collect in one place a large number of datasets in easy to read formats for a diverse set of problem classes. We provide archival links to datasets, description of the considered problems and problem formats, and a short summary of problem characteristics including size, number of instances etc. For reference we also give a non-exhaustive selection of algorithms proposed in the literature for their solution. We hope that this central repository will make benchmarking and comparison to established works easier. We welcome submission of interesting new datasets and algorithms for inclusion in our archive.
Distributed ensemble learning (DEL) involves training multiple models at distributed learners, and then combining their predictions to improve performance. Existing related studies focus on DEL algorithm design and optimization but ignore the important issue of incentives, without which self-interested learners may be unwilling to participate in DEL. We aim to fill this gap by presenting a first study on the incentive mechanism design for DEL. Our proposed mechanism specifies both the amount of training data and reward for learners with heterogeneous computation and communication costs. One design challenge is to have an accurate understanding regarding how learners' diversity (in terms of training data) affects the ensemble accuracy. To this end, we decompose the ensemble accuracy into a diversity-precision tradeoff to guide the mechanism design. Another challenge is that the mechanism design involves solving a mixed-integer program with a large search space. To this end, we propose an alternating algorithm that iteratively updates each learner's training data size and reward. We prove that under mild conditions, the algorithm converges. Numerical results using MNIST dataset show an interesting result: our proposed mechanism may prefer a lower level of learner diversity to achieve a higher ensemble accuracy.
Spiking neural networks (SNNs) have ultra-low energy consumption and high biological plausibility due to their binary and bio-driven nature compared with artificial neural networks (ANNs). While previous research has primarily focused on enhancing the performance of SNNs in classification tasks, the generative potential of SNNs remains relatively unexplored. In our paper, we put forward Spiking Denoising Diffusion Probabilistic Models (SDDPM), a new class of SNN-based generative models that achieve high sample quality. To fully exploit the energy efficiency of SNNs, we propose a purely Spiking U-Net architecture, which achieves comparable performance to its ANN counterpart using only 4 time steps, resulting in significantly reduced energy consumption. Extensive experimental results reveal that our approach achieves state-of-the-art on the generative tasks and substantially outperforms other SNN-based generative models, achieving up to $12\times$ and $6\times$ improvement on the CIFAR-10 and the CelebA datasets, respectively. Moreover, we propose a threshold-guided strategy that can further improve the performances by 16.7% in a training-free manner. The SDDPM symbolizes a significant advancement in the field of SNN generation, injecting new perspectives and potential avenues of exploration.
Numerous tools rely on automatic categorization of Android apps as part of their methodology. However, incorrect categorization can lead to inaccurate outcomes, such as a malware detector wrongly flagging a benign app as malicious. One such example is the SlideIT Free Keyboard app, which has over 500000 downloads on Google Play. Despite being a "Keyboard" app, it is often wrongly categorized alongside "Language" apps due to the app's description focusing heavily on language support, resulting in incorrect analysis outcomes, including mislabeling it as a potential malware when it is actually a benign app. Hence, there is a need to improve the categorization of Android apps to benefit all the tools relying on it. In this paper, we present a comprehensive evaluation of existing Android app categorization approaches using our new ground-truth dataset. Our evaluation demonstrates the notable superiority of approaches that utilize app descriptions over those solely relying on data extracted from the APK file, while also leaving space for potential improvement in the former category. Thus, we propose two innovative approaches that effectively outperform the performance of existing methods in both description-based and APK-based methodologies. Finally, by employing our novel description-based approach, we have successfully demonstrated that adopting a higher-performing categorization method can significantly benefit tools reliant on app categorization, leading to an improvement in their overall performance. This highlights the significance of developing advanced and efficient app categorization methodologies for improved results in software engineering tasks.
Recent contrastive representation learning methods rely on estimating mutual information (MI) between multiple views of an underlying context. E.g., we can derive multiple views of a given image by applying data augmentation, or we can split a sequence into views comprising the past and future of some step in the sequence. Contrastive lower bounds on MI are easy to optimize, but have a strong underestimation bias when estimating large amounts of MI. We propose decomposing the full MI estimation problem into a sum of smaller estimation problems by splitting one of the views into progressively more informed subviews and by applying the chain rule on MI between the decomposed views. This expression contains a sum of unconditional and conditional MI terms, each measuring modest chunks of the total MI, which facilitates approximation via contrastive bounds. To maximize the sum, we formulate a contrastive lower bound on the conditional MI which can be approximated efficiently. We refer to our general approach as Decomposed Estimation of Mutual Information (DEMI). We show that DEMI can capture a larger amount of MI than standard non-decomposed contrastive bounds in a synthetic setting, and learns better representations in a vision domain and for dialogue generation.
Deep learning methods for graphs achieve remarkable performance on many node-level and graph-level prediction tasks. However, despite the proliferation of the methods and their success, prevailing Graph Neural Networks (GNNs) neglect subgraphs, rendering subgraph prediction tasks challenging to tackle in many impactful applications. Further, subgraph prediction tasks present several unique challenges, because subgraphs can have non-trivial internal topology, but also carry a notion of position and external connectivity information relative to the underlying graph in which they exist. Here, we introduce SUB-GNN, a subgraph neural network to learn disentangled subgraph representations. In particular, we propose a novel subgraph routing mechanism that propagates neural messages between the subgraph's components and randomly sampled anchor patches from the underlying graph, yielding highly accurate subgraph representations. SUB-GNN specifies three channels, each designed to capture a distinct aspect of subgraph structure, and we provide empirical evidence that the channels encode their intended properties. We design a series of new synthetic and real-world subgraph datasets. Empirical results for subgraph classification on eight datasets show that SUB-GNN achieves considerable performance gains, outperforming strong baseline methods, including node-level and graph-level GNNs, by 12.4% over the strongest baseline. SUB-GNN performs exceptionally well on challenging biomedical datasets when subgraphs have complex topology and even comprise multiple disconnected components.
Graph neural networks (GNNs) have been widely used in representation learning on graphs and achieved state-of-the-art performance in tasks such as node classification and link prediction. However, most existing GNNs are designed to learn node representations on the fixed and homogeneous graphs. The limitations especially become problematic when learning representations on a misspecified graph or a heterogeneous graph that consists of various types of nodes and edges. In this paper, we propose Graph Transformer Networks (GTNs) that are capable of generating new graph structures, which involve identifying useful connections between unconnected nodes on the original graph, while learning effective node representation on the new graphs in an end-to-end fashion. Graph Transformer layer, a core layer of GTNs, learns a soft selection of edge types and composite relations for generating useful multi-hop connections so-called meta-paths. Our experiments show that GTNs learn new graph structures, based on data and tasks without domain knowledge, and yield powerful node representation via convolution on the new graphs. Without domain-specific graph preprocessing, GTNs achieved the best performance in all three benchmark node classification tasks against the state-of-the-art methods that require pre-defined meta-paths from domain knowledge.
Graph neural networks (GNNs) are a popular class of machine learning models whose major advantage is their ability to incorporate a sparse and discrete dependency structure between data points. Unfortunately, GNNs can only be used when such a graph-structure is available. In practice, however, real-world graphs are often noisy and incomplete or might not be available at all. With this work, we propose to jointly learn the graph structure and the parameters of graph convolutional networks (GCNs) by approximately solving a bilevel program that learns a discrete probability distribution on the edges of the graph. This allows one to apply GCNs not only in scenarios where the given graph is incomplete or corrupted but also in those where a graph is not available. We conduct a series of experiments that analyze the behavior of the proposed method and demonstrate that it outperforms related methods by a significant margin.
This paper proposes a method to modify traditional convolutional neural networks (CNNs) into interpretable CNNs, in order to clarify knowledge representations in high conv-layers of CNNs. In an interpretable CNN, each filter in a high conv-layer represents a certain object part. We do not need any annotations of object parts or textures to supervise the learning process. Instead, the interpretable CNN automatically assigns each filter in a high conv-layer with an object part during the learning process. Our method can be applied to different types of CNNs with different structures. The clear knowledge representation in an interpretable CNN can help people understand the logics inside a CNN, i.e., based on which patterns the CNN makes the decision. Experiments showed that filters in an interpretable CNN were more semantically meaningful than those in traditional CNNs.
The dominant sequence transduction models are based on complex recurrent or convolutional neural networks in an encoder-decoder configuration. The best performing models also connect the encoder and decoder through an attention mechanism. We propose a new simple network architecture, the Transformer, based solely on attention mechanisms, dispensing with recurrence and convolutions entirely. Experiments on two machine translation tasks show these models to be superior in quality while being more parallelizable and requiring significantly less time to train. Our model achieves 28.4 BLEU on the WMT 2014 English-to-German translation task, improving over the existing best results, including ensembles by over 2 BLEU. On the WMT 2014 English-to-French translation task, our model establishes a new single-model state-of-the-art BLEU score of 41.8 after training for 3.5 days on eight GPUs, a small fraction of the training costs of the best models from the literature. We show that the Transformer generalizes well to other tasks by applying it successfully to English constituency parsing both with large and limited training data.
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