In the last decades, the capacity to generate large amounts of data in science and engineering applications has been growing steadily. Meanwhile, the progress in machine learning has turned it into a suitable tool to process and utilise the available data. Nonetheless, many relevant scientific and engineering problems present challenges where current machine learning methods cannot yet efficiently leverage the available data and resources. For example, in scientific discovery, we are often faced with the problem of exploring very large, high-dimensional spaces, where querying a high fidelity, black-box objective function is very expensive. Progress in machine learning methods that can efficiently tackle such problems would help accelerate currently crucial areas such as drug and materials discovery. In this paper, we propose the use of GFlowNets for multi-fidelity active learning, where multiple approximations of the black-box function are available at lower fidelity and cost. GFlowNets are recently proposed methods for amortised probabilistic inference that have proven efficient for exploring large, high-dimensional spaces and can hence be practical in the multi-fidelity setting too. Here, we describe our algorithm for multi-fidelity active learning with GFlowNets and evaluate its performance in both well-studied synthetic tasks and practically relevant applications of molecular discovery. Our results show that multi-fidelity active learning with GFlowNets can efficiently leverage the availability of multiple oracles with different costs and fidelities to accelerate scientific discovery and engineering design.
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The recent development of integrated sensing and communications (ISAC) technology offers new opportunities to meet high-throughput and low-latency communication as well as high-resolution localization requirements in vehicular networks. However, considering the limited transmit power of the road site units (RSUs) and the relatively small radar cross section (RCS) of vehicles with random reflection coefficients, the power of echo signals may be too weak to be utilized for effective target detection and tracking. Moreover, high-frequency signals usually suffer from large fading loss when penetrating vehicles, which seriously degrades the quality of communication services inside the vehicles. To handle this issue, we propose a novel sensing-assisted communication mechanism by employing an intelligent omni-surface (IOS) on the surface of vehicles to enhance both sensing and communication (S&C) performance. To this end, we first propose a two-stage ISAC protocol, including the joint S&C stage and the communication-only stage, to fulfill more efficient communication performance improvements benefited from sensing. The achievable communication rate maximization problem is formulated by jointly optimizing the transmit beamforming, the IOS phase shifts, and the duration of the joint S&C stage. However, solving this ISAC optimization problem is highly non-trivial since inaccurate estimation and measurement information renders the achievable rate lack of closed-form expression. To handle this issue, we first derive a closed-form expression of the achievable rate under uncertain location information, and then unveil a sufficient and necessary condition for the existence of the joint S&C stage to offer useful insights for practical system design. Moreover, two typical scenarios including interference-limited and noise-limited cases are analyzed.
The ability to interpret machine learning models has become increasingly important as their usage in data science continues to rise. Most current interpretability methods are optimized to work on either (\textit{i}) a global scale, where the goal is to rank features based on their contributions to overall variation in an observed population, or (\textit{ii}) the local level, which aims to detail on how important a feature is to a particular individual in the data set. In this work, a new operator is proposed called the "GlObal And Local Score" (GOALS): a simple \textit{post hoc} approach to simultaneously assess local and global feature variable importance in nonlinear models. Motivated by problems in biomedicine, the approach is demonstrated using Gaussian process regression where the task of understanding how genetic markers are associated with disease progression both within individuals and across populations is of high interest. Detailed simulations and real data analyses illustrate the flexible and efficient utility of GOALS over state-of-the-art variable importance strategies.
Human motion prediction (HMP) has emerged as a popular research topic due to its diverse applications, but it remains a challenging task due to the stochastic and aperiodic nature of future poses. Traditional methods rely on hand-crafted features and machine learning techniques, which often struggle to model the complex dynamics of human motion. Recent deep learning-based methods have achieved success by learning spatio-temporal representations of motion, but these models often overlook the reliability of motion data. Additionally, the temporal and spatial dependencies of skeleton nodes are distinct. The temporal relationship captures motion information over time, while the spatial relationship describes body structure and the relationships between different nodes. In this paper, we propose a novel spatio-temporal branching network using incremental information for HMP, which decouples the learning of temporal-domain and spatial-domain features, extracts more motion information, and achieves complementary cross-domain knowledge learning through knowledge distillation. Our approach effectively reduces noise interference and provides more expressive information for characterizing motion by separately extracting temporal and spatial features. We evaluate our approach on standard HMP benchmarks and outperform state-of-the-art methods in terms of prediction accuracy.
After completing the design and training phases, deploying a deep learning model onto specific hardware is essential before practical implementation. Targeted optimizations are necessary to enhance the model's performance by reducing inference latency. Auto-scheduling, an automated technique offering various optimization options, proves to be a viable solution for large-scale auto-deployment. However, the low-level code generated by auto-scheduling resembles hardware coding, potentially hindering human comprehension and impeding manual optimization efforts. In this ongoing study, we aim to develop an enhanced visualization that effectively addresses the extensive profiling metrics associated with auto-scheduling. This visualization will illuminate the intricate scheduling process, enabling further advancements in latency optimization through insights derived from the schedule.
Maximum mean discrepancy (MMD) has enjoyed a lot of success in many machine learning and statistical applications, including non-parametric hypothesis testing, because of its ability to handle non-Euclidean data. Recently, it has been demonstrated in Balasubramanian et al.(2021) that the goodness-of-fit test based on MMD is not minimax optimal while a Tikhonov regularized version of it is, for an appropriate choice of the regularization parameter. However, the results in Balasubramanian et al. (2021) are obtained under the restrictive assumptions of the mean element being zero, and the uniform boundedness condition on the eigenfunctions of the integral operator. Moreover, the test proposed in Balasubramanian et al. (2021) is not practical as it is not computable for many kernels. In this paper, we address these shortcomings and extend the results to general spectral regularizers that include Tikhonov regularization.
Large Language Models (LLMs) have sparked significant interest in their generative capabilities, leading to the development of various commercial applications. The high cost of using the models drives application builders to maximize the value of generation under a limited inference budget. This paper presents a study of optimizing inference hyperparameters such as the number of responses, temperature and max tokens, which significantly affects the utility/cost of text generation. We design a framework named EcoOptiGen which leverages economical hyperparameter optimization and cost-based pruning. Experiments with the GPT-3.5/GPT-4 models on a variety of tasks verify its effectiveness. EcoOptiGen is implemented in the `autogen' package of the FLAML library: \url{//aka.ms/autogen}.
Despite the recent progress in deep learning, most approaches still go for a silo-like solution, focusing on learning each task in isolation: training a separate neural network for each individual task. Many real-world problems, however, call for a multi-modal approach and, therefore, for multi-tasking models. Multi-task learning (MTL) aims to leverage useful information across tasks to improve the generalization capability of a model. This thesis is concerned with multi-task learning in the context of computer vision. First, we review existing approaches for MTL. Next, we propose several methods that tackle important aspects of multi-task learning. The proposed methods are evaluated on various benchmarks. The results show several advances in the state-of-the-art of multi-task learning. Finally, we discuss several possibilities for future work.
With the explosive growth of information technology, multi-view graph data have become increasingly prevalent and valuable. Most existing multi-view clustering techniques either focus on the scenario of multiple graphs or multi-view attributes. In this paper, we propose a generic framework to cluster multi-view attributed graph data. Specifically, inspired by the success of contrastive learning, we propose multi-view contrastive graph clustering (MCGC) method to learn a consensus graph since the original graph could be noisy or incomplete and is not directly applicable. Our method composes of two key steps: we first filter out the undesirable high-frequency noise while preserving the graph geometric features via graph filtering and obtain a smooth representation of nodes; we then learn a consensus graph regularized by graph contrastive loss. Results on several benchmark datasets show the superiority of our method with respect to state-of-the-art approaches. In particular, our simple approach outperforms existing deep learning-based methods.
While recent studies on semi-supervised learning have shown remarkable progress in leveraging both labeled and unlabeled data, most of them presume a basic setting of the model is randomly initialized. In this work, we consider semi-supervised learning and transfer learning jointly, leading to a more practical and competitive paradigm that can utilize both powerful pre-trained models from source domain as well as labeled/unlabeled data in the target domain. To better exploit the value of both pre-trained weights and unlabeled target examples, we introduce adaptive consistency regularization that consists of two complementary components: Adaptive Knowledge Consistency (AKC) on the examples between the source and target model, and Adaptive Representation Consistency (ARC) on the target model between labeled and unlabeled examples. Examples involved in the consistency regularization are adaptively selected according to their potential contributions to the target task. We conduct extensive experiments on several popular benchmarks including CUB-200-2011, MIT Indoor-67, MURA, by fine-tuning the ImageNet pre-trained ResNet-50 model. Results show that our proposed adaptive consistency regularization outperforms state-of-the-art semi-supervised learning techniques such as Pseudo Label, Mean Teacher, and MixMatch. Moreover, our algorithm is orthogonal to existing methods and thus able to gain additional improvements on top of MixMatch and FixMatch. Our code is available at //github.com/SHI-Labs/Semi-Supervised-Transfer-Learning.
Mining graph data has become a popular research topic in computer science and has been widely studied in both academia and industry given the increasing amount of network data in the recent years. However, the huge amount of network data has posed great challenges for efficient analysis. This motivates the advent of graph representation which maps the graph into a low-dimension vector space, keeping original graph structure and supporting graph inference. The investigation on efficient representation of a graph has profound theoretical significance and important realistic meaning, we therefore introduce some basic ideas in graph representation/network embedding as well as some representative models in this chapter.
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