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We present a numerically robust algorithm for computing the constrained Delaunay tetrahedrization (CDT) of a piecewise-linear complex, which has a 100% success rate on the 4408 valid models in the Thingi10k dataset. We build on the underlying theory of the well-known TetGen software, but use a floating-point implementation based on indirect geometric predicates to implicitly represent Steiner points: this new approach dramatically simplifies the implementation, removing the need for ad-hoc tolerances in geometric operations. Our approach leads to a robust and parameter-free implementation, with an empirically manageable number of added Steiner points. Furthermore, our algorithm addresses a major gap in TetGen's theory which may lead to algorithmic failure on valid models, even when assuming perfect precision in the calculations. Our output tetrahedrization conforms with the input geometry without approximations. We can further round our output to floating-point coordinates for downstream applications, which almost always results in valid floating-point meshes unless the input triangulation is very close to being degenerate.

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We study the problem of improving the efficiency of segmentation transformers by using disparate amounts of computation for different parts of the image. Our method, PAUMER, accomplishes this by pausing computation for patches that are deemed to not need any more computation before the final decoder. We use the entropy of predictions computed from intermediate activations as the pausing criterion, and find this aligns well with semantics of the image. Our method has a unique advantage that a single network trained with the proposed strategy can be effortlessly adapted at inference to various run-time requirements by modulating its pausing parameters. On two standard segmentation datasets, Cityscapes and ADE20K, we show that our method operates with about a $50\%$ higher throughput with an mIoU drop of about $0.65\%$ and $4.6\%$ respectively.

Multivariate Time Series (MVTS) anomaly detection is a long-standing and challenging research topic that has attracted tremendous research effort from both industry and academia recently. However, a careful study of the literature makes us realize that 1) the community is active but not as organized as other sibling machine learning communities such as Computer Vision (CV) and Natural Language Processing (NLP), and 2) most proposed solutions are evaluated using either inappropriate or highly flawed protocols, with an apparent lack of scientific foundation. So flawed is one very popular protocol, the so-called point-adjust protocol, that a random guess can be shown to systematically outperform all algorithms developed so far. In this paper, we review and evaluate many recent algorithms using more robust protocols and discuss how a normally good protocol may have weaknesses in the context of MVTS anomaly detection and how to mitigate them. We also share our concerns about benchmark datasets, experiment design and evaluation methodology we observe in many works. Furthermore, we propose a simple, yet challenging, baseline based on Principal Components Analysis (PCA) that surprisingly outperforms many recent Deep Learning (DL) based approaches on popular benchmark datasets. The main objective of this work is to stimulate more effort towards important aspects of the research such as data, experiment design, evaluation methodology and result interpretability, instead of putting the highest weight on the design of increasingly more complex and "fancier" algorithms.

We analyze asynchronous-type algorithms for distributed SGD in the heterogeneous setting, where each worker has its own computation and communication speeds, as well as data distribution. In these algorithms, workers compute possibly stale and stochastic gradients associated with their local data at some iteration back in history and then return those gradients to the server without synchronizing with other workers. We present a unified convergence theory for non-convex smooth functions in the heterogeneous regime. The proposed analysis provides convergence for pure asynchronous SGD and its various modifications. Moreover, our theory explains what affects the convergence rate and what can be done to improve the performance of asynchronous algorithms. In particular, we introduce a novel asynchronous method based on worker shuffling. As a by-product of our analysis, we also demonstrate convergence guarantees for gradient-type algorithms such as SGD with random reshuffling and shuffle-once mini-batch SGD. The derived rates match the best-known results for those algorithms, highlighting the tightness of our approach. Finally, our numerical evaluations support theoretical findings and show the good practical performance of our method.

Modeling spatiotemporal brain dynamics from high-dimensional data, such as functional Magnetic Resonance Imaging (fMRI), is a formidable task in neuroscience. Existing approaches for fMRI analysis utilize hand-crafted features, but the process of feature extraction risks losing essential information in fMRI scans. To address this challenge, we present SwiFT (Swin 4D fMRI Transformer), a Swin Transformer architecture that can learn brain dynamics directly from fMRI volumes in a memory and computation-efficient manner. SwiFT achieves this by implementing a 4D window multi-head self-attention mechanism and absolute positional embeddings. We evaluate SwiFT using multiple large-scale resting-state fMRI datasets, including the Human Connectome Project (HCP), Adolescent Brain Cognitive Development (ABCD), and UK Biobank (UKB) datasets, to predict sex, age, and cognitive intelligence. Our experimental outcomes reveal that SwiFT consistently outperforms recent state-of-the-art models. Furthermore, by leveraging its end-to-end learning capability, we show that contrastive loss-based self-supervised pre-training of SwiFT can enhance performance on downstream tasks. Additionally, we employ an explainable AI method to identify the brain regions associated with sex classification. To our knowledge, SwiFT is the first Swin Transformer architecture to process dimensional spatiotemporal brain functional data in an end-to-end fashion. Our work holds substantial potential in facilitating scalable learning of functional brain imaging in neuroscience research by reducing the hurdles associated with applying Transformer models to high-dimensional fMRI.

Evolutionary algorithms (EAs) have achieved remarkable success in tackling complex combinatorial optimization problems. However, EAs often demand carefully-designed operators with the aid of domain expertise to achieve satisfactory performance. In this work, we present the first study on large language models (LLMs) as evolutionary combinatorial optimizers. The main advantage is that it requires minimal domain knowledge and human efforts, as well as no additional training of the model. This approach is referred to as LLM-driven EA (LMEA). Specifically, in each generation of the evolutionary search, LMEA instructs the LLM to select parent solutions from current population, and perform crossover and mutation to generate offspring solutions. Then, LMEA evaluates these new solutions and include them into the population for the next generation. LMEA is equipped with a self-adaptation mechanism that controls the temperature of the LLM. This enables it to balance between exploration and exploitation and prevents the search from getting stuck in local optima. We investigate the power of LMEA on the classical traveling salesman problems (TSPs) widely used in combinatorial optimization research. Notably, the results show that LMEA performs competitively to traditional heuristics in finding high-quality solutions on TSP instances with up to 20 nodes. Additionally, we also study the effectiveness of LLM-driven crossover/mutation and the self-adaptation mechanism in evolutionary search. In summary, our results reveal the great potentials of LLMs as evolutionary optimizers for solving combinatorial problems. We hope our research shall inspire future explorations on LLM-driven EAs for complex optimization challenges.

In $\mathbb R^d$, it is well-known that cumulants provide an alternative to moments that can achieve the same goals with numerous benefits such as lower variance estimators. In this paper we extend cumulants to reproducing kernel Hilbert spaces (RKHS) using tools from tensor algebras and show that they are computationally tractable by a kernel trick. These kernelized cumulants provide a new set of all-purpose statistics; the classical maximum mean discrepancy and Hilbert-Schmidt independence criterion arise as the degree one objects in our general construction. We argue both theoretically and empirically (on synthetic, environmental, and traffic data analysis) that going beyond degree one has several advantages and can be achieved with the same computational complexity and minimal overhead in our experiments.

The theory underlying robust distributed learning algorithms, designed to resist adversarial machines, matches empirical observations when data is homogeneous. Under data heterogeneity however, which is the norm in practical scenarios, established lower bounds on the learning error are essentially vacuous and greatly mismatch empirical observations. This is because the heterogeneity model considered is too restrictive and does not cover basic learning tasks such as least-squares regression. We consider in this paper a more realistic heterogeneity model, namely (G,B)-gradient dissimilarity, and show that it covers a larger class of learning problems than existing theory. Notably, we show that the breakdown point under heterogeneity is lower than the classical fraction 1/2. We also prove a new lower bound on the learning error of any distributed learning algorithm. We derive a matching upper bound for a robust variant of distributed gradient descent, and empirically show that our analysis reduces the gap between theory and practice.

Decision analysis deals with modeling and enhancing decision processes. A principal challenge in improving behavior is in obtaining a transparent description of existing behavior in the first place. In this paper, we develop an expressive, unifying perspective on inverse decision modeling: a framework for learning parameterized representations of sequential decision behavior. First, we formalize the forward problem (as a normative standard), subsuming common classes of control behavior. Second, we use this to formalize the inverse problem (as a descriptive model), generalizing existing work on imitation/reward learning -- while opening up a much broader class of research problems in behavior representation. Finally, we instantiate this approach with an example (inverse bounded rational control), illustrating how this structure enables learning (interpretable) representations of (bounded) rationality -- while naturally capturing intuitive notions of suboptimal actions, biased beliefs, and imperfect knowledge of environments.

Existing regression models tend to fall short in both accuracy and uncertainty estimation when the label distribution is imbalanced. In this paper, we propose a probabilistic deep learning model, dubbed variational imbalanced regression (VIR), which not only performs well in imbalanced regression but naturally produces reasonable uncertainty estimation as a byproduct. Different from typical variational autoencoders assuming I.I.D. representations (a data point's representation is not directly affected by other data points), our VIR borrows data with similar regression labels to compute the latent representation's variational distribution; furthermore, different from deterministic regression models producing point estimates, VIR predicts the entire normal-inverse-gamma distributions and modulates the associated conjugate distributions to impose probabilistic reweighting on the imbalanced data, thereby providing better uncertainty estimation. Experiments in several real-world datasets show that our VIR can outperform state-of-the-art imbalanced regression models in terms of both accuracy and uncertainty estimation. Code will soon be available at //github.com/Wang-ML-Lab/variational-imbalanced-regression.

Causal Machine Learning (CausalML) is an umbrella term for machine learning methods that formalize the data-generation process as a structural causal model (SCM). This allows one to reason about the effects of changes to this process (i.e., interventions) and what would have happened in hindsight (i.e., counterfactuals). We categorize work in \causalml into five groups according to the problems they tackle: (1) causal supervised learning, (2) causal generative modeling, (3) causal explanations, (4) causal fairness, (5) causal reinforcement learning. For each category, we systematically compare its methods and point out open problems. Further, we review modality-specific applications in computer vision, natural language processing, and graph representation learning. Finally, we provide an overview of causal benchmarks and a critical discussion of the state of this nascent field, including recommendations for future work.

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