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Successful detection of Out-of-Distribution (OoD) data is becoming increasingly important to ensure safe deployment of neural networks. One of the main challenges in OoD detection is that neural networks output overconfident predictions on OoD data, make it difficult to determine OoD-ness of data solely based on their predictions. Outlier exposure addresses this issue by introducing an additional loss that encourages low-confidence predictions on OoD data during training. While outlier exposure has shown promising potential in improving OoD detection performance, all previous studies on outlier exposure have been limited to utilizing visual outliers. Drawing inspiration from the recent advancements in vision-language pre-training, this paper venture out to the uncharted territory of textual outlier exposure. First, we uncover the benefits of using textual outliers by replacing real or virtual outliers in the image-domain with textual equivalents. Then, we propose various ways of generating preferable textual outliers. Our extensive experiments demonstrate that generated textual outliers achieve competitive performance on large-scale OoD and hard OoD benchmarks. Furthermore, we conduct empirical analyses of textual outliers to provide primary criteria for designing advantageous textual outliers: near-distribution, descriptiveness, and inclusion of visual semantics.

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Uncertainty quantification is a pivotal field that contributes to the realization of reliable and robust systems. By providing complementary information, it becomes instrumental in fortifying safe decisions, particularly within high-risk applications. Nevertheless, a comprehensive understanding of the advantages and limitations inherent in various methods within the medical imaging field necessitates further research coupled with in-depth analysis. In this paper, we explore Conformal Prediction, an emerging distribution-free uncertainty quantification technique, along with Monte Carlo Dropout and Evidential Deep Learning methods. Our comprehensive experiments provide a comparative performance analysis for skin lesion classification tasks across the three quantification methods. Furthermore, We present insights into the effectiveness of each method in handling Out-of-Distribution samples from domain-shifted datasets. Based on our experimental findings, our conclusion highlights the robustness and consistent performance of conformal prediction across diverse conditions. This positions it as the preferred choice for decision-making in safety-critical applications.

The expanding application of Artificial Intelligence (AI) in scientific fields presents unprecedented opportunities for discovery and innovation. However, this growth is not without risks. AI models in science, if misused, can amplify risks like creation of harmful substances, or circumvention of established regulations. In this study, we aim to raise awareness of the dangers of AI misuse in science, and call for responsible AI development and use in this domain. We first itemize the risks posed by AI in scientific contexts, then demonstrate the risks by highlighting real-world examples of misuse in chemical science. These instances underscore the need for effective risk management strategies. In response, we propose a system called SciGuard to control misuse risks for AI models in science. We also propose a red-teaming benchmark SciMT-Safety to assess the safety of different systems. Our proposed SciGuard shows the least harmful impact in the assessment without compromising performance in benign tests. Finally, we highlight the need for a multidisciplinary and collaborative effort to ensure the safe and ethical use of AI models in science. We hope that our study can spark productive discussions on using AI ethically in science among researchers, practitioners, policymakers, and the public, to maximize benefits and minimize the risks of misuse.

One of the motivations for explainable AI is to allow humans to make better and more informed decisions regarding the use and deployment of AI models. But careful evaluations are needed to assess whether this expectation has been fulfilled. Current evaluations mainly focus on algorithmic properties of explanations, and those that involve human subjects often employ subjective questions to test human's perception of explanation usefulness, without being grounded in objective metrics and measurements. In this work, we evaluate whether explanations can improve human decision-making in practical scenarios of machine learning model development. We conduct a mixed-methods user study involving image data to evaluate saliency maps generated by SmoothGrad, GradCAM, and an oracle explanation on two tasks: model selection and counterfactual simulation. To our surprise, we did not find evidence of significant improvement on these tasks when users were provided with any of the saliency maps, even the synthetic oracle explanation designed to be simple to understand and highly indicative of the answer. Nonetheless, explanations did help users more accurately describe the models. These findings suggest caution regarding the usefulness and potential for misunderstanding in saliency-based explanations.

The resolution is an important performance metric of near-field communication networks. In particular, the resolution of near field beamforming measures how effectively users can be distinguished in the distance-angle domain, which is one of the most significant features of near-field communications. In a comparison, conventional far-field beamforming can distinguish users in the angle domain only, which means that near-field communication yields the full utilization of user spatial resources to improve spectrum efficiency. In the literature of near-field communications, there have been a few studies on whether the resolution of near-field beamforming is perfect. However, each of the existing results suffers its own limitations, e.g., each is accurate for special cases only, and cannot precisely and comprehensively characterize the resolution. In this letter, a general analytical framework is developed to evaluate the resolution of near-field beamforming. Based on this derived expression, the impacts of parameters on the resolution are investigated, which can shed light on the design of the near-field communications, including the designs of beamforming and multiple access tequniques.

Topology identification (TI) is a key task for state estimation (SE) in distribution grids, especially the one with high-penetration renewables. The uncertainties, initiated by the time-series behavior of renewables, will almost certainly lead to bad TI results without a proper treatment. These uncertainties are analytically intractable under conventional framework-they are usually jointly spatial-temporal dependent, and hence cannot be simply treated as white noise. For this purpose, a hybrid framework is suggested in this paper to handle these uncertainties in a systematic and theoretical way; in particular, big data analytics are studied to harness the jointly spatial-temporal statistical properties of those uncertainties. With some prior knowledge, a model bank is built first to store the countable typical models of network configurations; therefore, the difference between the SE outputs of each bank model and our observation is capable of being defined as a matrix variate-the so-called random matrix. In order to gain insight into the random matrix, a well-designed metric space is needed. Auto-regression (AR) model, factor analysis (FA), and random matrix theory (RMT) are tied together for the metric space design, followed by jointly temporal-spatial analysis of those matrices which is conducted in a high-dimensional (vector) space. Under the proposed framework, some big data analytics and theoretical results are obtained to improve the TI performance. Our framework is validated using IEEE standard distribution network with some field data in practice.

In causal inference, it is a fundamental task to estimate the causal effect from observational data. However, latent confounders pose major challenges in causal inference in observational data, for example, confounding bias and M-bias. Recent data-driven causal effect estimators tackle the confounding bias problem via balanced representation learning, but assume no M-bias in the system, thus they fail to handle the M-bias. In this paper, we identify a challenging and unsolved problem caused by a variable that leads to confounding bias and M-bias simultaneously. To address this problem with co-occurring M-bias and confounding bias, we propose a novel Disentangled Latent Representation learning framework for learning latent representations from proxy variables for unbiased Causal effect Estimation (DLRCE) from observational data. Specifically, DLRCE learns three sets of latent representations from the measured proxy variables to adjust for the confounding bias and M-bias. Extensive experiments on both synthetic and three real-world datasets demonstrate that DLRCE significantly outperforms the state-of-the-art estimators in the case of the presence of both confounding bias and M-bias.

The healthcare industry generates enormous amounts of complex clinical data that make the prediction of disease detection a complicated process. In medical informatics, making effective and efficient decisions is very important. Data Mining (DM) techniques are mainly used to identify and extract hidden patterns and interesting knowledge to diagnose and predict diseases in medical datasets. Nowadays, heart disease is considered one of the most important problems in the healthcare field. Therefore, early diagnosis leads to a reduction in deaths. DM techniques have proven highly effective for predicting and diagnosing heart diseases. This work utilizes the classification algorithms with a medical dataset of heart disease; namely, J48, Random Forest, and Na\"ive Bayes to discover the accuracy of their performance. We also examine the impact of the feature selection method. A comparative and analysis study was performed to determine the best technique using Waikato Environment for Knowledge Analysis (Weka) software, version 3.8.6. The performance of the utilized algorithms was evaluated using standard metrics such as accuracy, sensitivity and specificity. The importance of using classification techniques for heart disease diagnosis has been highlighted. We also reduced the number of attributes in the dataset, which showed a significant improvement in prediction accuracy. The results indicate that the best algorithm for predicting heart disease was Random Forest with an accuracy of 99.24%.

Recently, graph neural networks have been gaining a lot of attention to simulate dynamical systems due to their inductive nature leading to zero-shot generalizability. Similarly, physics-informed inductive biases in deep-learning frameworks have been shown to give superior performance in learning the dynamics of physical systems. There is a growing volume of literature that attempts to combine these two approaches. Here, we evaluate the performance of thirteen different graph neural networks, namely, Hamiltonian and Lagrangian graph neural networks, graph neural ODE, and their variants with explicit constraints and different architectures. We briefly explain the theoretical formulation highlighting the similarities and differences in the inductive biases and graph architecture of these systems. We evaluate these models on spring, pendulum, gravitational, and 3D deformable solid systems to compare the performance in terms of rollout error, conserved quantities such as energy and momentum, and generalizability to unseen system sizes. Our study demonstrates that GNNs with additional inductive biases, such as explicit constraints and decoupling of kinetic and potential energies, exhibit significantly enhanced performance. Further, all the physics-informed GNNs exhibit zero-shot generalizability to system sizes an order of magnitude larger than the training system, thus providing a promising route to simulate large-scale realistic systems.

As soon as abstract mathematical computations were adapted to computation on digital computers, the problem of efficient representation, manipulation, and communication of the numerical values in those computations arose. Strongly related to the problem of numerical representation is the problem of quantization: in what manner should a set of continuous real-valued numbers be distributed over a fixed discrete set of numbers to minimize the number of bits required and also to maximize the accuracy of the attendant computations? This perennial problem of quantization is particularly relevant whenever memory and/or computational resources are severely restricted, and it has come to the forefront in recent years due to the remarkable performance of Neural Network models in computer vision, natural language processing, and related areas. Moving from floating-point representations to low-precision fixed integer values represented in four bits or less holds the potential to reduce the memory footprint and latency by a factor of 16x; and, in fact, reductions of 4x to 8x are often realized in practice in these applications. Thus, it is not surprising that quantization has emerged recently as an important and very active sub-area of research in the efficient implementation of computations associated with Neural Networks. In this article, we survey approaches to the problem of quantizing the numerical values in deep Neural Network computations, covering the advantages/disadvantages of current methods. With this survey and its organization, we hope to have presented a useful snapshot of the current research in quantization for Neural Networks and to have given an intelligent organization to ease the evaluation of future research in this area.

Object detection typically assumes that training and test data are drawn from an identical distribution, which, however, does not always hold in practice. Such a distribution mismatch will lead to a significant performance drop. In this work, we aim to improve the cross-domain robustness of object detection. We tackle the domain shift on two levels: 1) the image-level shift, such as image style, illumination, etc, and 2) the instance-level shift, such as object appearance, size, etc. We build our approach based on the recent state-of-the-art Faster R-CNN model, and design two domain adaptation components, on image level and instance level, to reduce the domain discrepancy. The two domain adaptation components are based on H-divergence theory, and are implemented by learning a domain classifier in adversarial training manner. The domain classifiers on different levels are further reinforced with a consistency regularization to learn a domain-invariant region proposal network (RPN) in the Faster R-CNN model. We evaluate our newly proposed approach using multiple datasets including Cityscapes, KITTI, SIM10K, etc. The results demonstrate the effectiveness of our proposed approach for robust object detection in various domain shift scenarios.

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