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Maximum likelihood estimation (MLE) is a fundamental problem in statistics. Characteristics of the MLE problem for algebraic statistical models are reflected in the geometry of the \textit{likelihood correspondence}, a variety that ties together data and their maximum likelihood estimators. We construct the ideal of the likelihood correspondence for the large class of toric models and find a Gr\"{o}bner basis in the case of complete and joint independence models arising from multi-way contingency tables. These results provide insight into their properties and offer faster computational strategies for solving the MLE problem.

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Motivated by the growing interest in correlation-robust stochastic optimization, we investigate stochastic selection problems beyond independence. Specifically, we consider the instructive case of pairwise-independent priors and matroid constraints. We obtain essentially-optimal bounds for contention resolution and prophet inequalities. The impetus for our work comes from the recent work of Caragiannis et al., who derived a constant-approximation for the single-choice prophet inequality with pairwise-independent priors. For general matroids, our results are tight and largely negative. For both contention resolution and prophet inequalities, our impossibility results hold for the full linear matroid over a finite field. We explicitly construct pairwise-independent distributions which rule out an omega(1/Rank)-balanced offline CRS and an omega(1/log Rank)-competitive prophet inequality against the (usual) oblivious adversary. For both results, we employ a generic approach for constructing pairwise-independent random vectors -- one which unifies and generalizes existing pairwise-independence constructions from the literature on universal hash functions and pseudorandomness. Specifically, our approach is based on our observation that random linear maps turn linear independence into stochastic independence. We then examine the class of matroids which satisfy the so-called partition property -- these include most common matroids encountered in optimization. We obtain positive results for both online contention resolution and prophet inequalities with pairwise-independent priors on such matroids, approximately matching the corresponding guarantees for fully independent priors. These algorithmic results hold against the almighty adversary for both problems.

Average Treatment Effect (ATE) estimation is a well-studied problem in causal inference. However, it does not necessarily capture the heterogeneity in the data, and several approaches have been proposed to tackle the issue, including estimating the Quantile Treatment Effects. In the finite population setting containing $n$ individuals, with treatment and control values denoted by the potential outcome vectors $\mathbf{a}, \mathbf{b}$, much of the prior work focused on estimating median$(\mathbf{a}) -$ median$(\mathbf{b})$, where median($\mathbf x$) denotes the median value in the sorted ordering of all the values in vector $\mathbf x$. It is known that estimating the difference of medians is easier than the desired estimand of median$(\mathbf{a-b})$, called the Median Treatment Effect (MTE). The fundamental problem of causal inference -- for every individual $i$, we can only observe one of the potential outcome values, i.e., either the value $a_i$ or $b_i$, but not both, makes estimating MTE particularly challenging. In this work, we argue that MTE is not estimable and detail a novel notion of approximation that relies on the sorted order of the values in $\mathbf{a-b}$. Next, we identify a quantity called variability that exactly captures the complexity of MTE estimation. By drawing connections to instance-optimality studied in theoretical computer science, we show that every algorithm for estimating the MTE obtains an approximation error that is no better than the error of an algorithm that computes variability. Finally, we provide a simple linear time algorithm for computing the variability exactly. Unlike much prior work, a particular highlight of our work is that we make no assumptions about how the potential outcome vectors are generated or how they are correlated, except that the potential outcome values are $k$-ary, i.e., take one of $k$ discrete values.

We prove impossibility results for adaptivity in non-smooth stochastic convex optimization. Given a set of problem parameters we wish to adapt to, we define a "price of adaptivity" (PoA) that, roughly speaking, measures the multiplicative increase in suboptimality due to uncertainty in these parameters. When the initial distance to the optimum is unknown but a gradient norm bound is known, we show that the PoA is at least logarithmic for expected suboptimality, and double-logarithmic for median suboptimality. When there is uncertainty in both distance and gradient norm, we show that the PoA must be polynomial in the level of uncertainty. Our lower bounds nearly match existing upper bounds, and establish that there is no parameter-free lunch.

We build on recent research on polynomial randomized approximation (PRAX) algorithms for the hard problems of NFA universality and NFA equivalence. Loosely speaking, PRAX algorithms use sampling of infinite domains within any desired accuracy $\delta$. In the spirit of experimental mathematics, we extend the concept of PRAX algorithms to be applicable to the emptiness and universality problems in any domain whose instances admit a tractable distribution as defined in this paper. A technical result here is that a linear (w.r.t. $1/\delta$) number of samples is sufficient, as opposed to the quadratic number of samples in previous papers. We show how the improved and generalized PRAX algorithms apply to universality and emptiness problems in various domains: ordinary automata, tautology testing of propositions, 2D automata, and to solution sets of certain Diophantine equations.

Large Language Models (LLMs) have shown excellent generalization capabilities that have led to the development of numerous models. These models propose various new architectures, tweaking existing architectures with refined training strategies, increasing context length, using high-quality training data, and increasing training time to outperform baselines. Analyzing new developments is crucial for identifying changes that enhance training stability and improve generalization in LLMs. This survey paper comprehensively analyses the LLMs architectures and their categorization, training strategies, training datasets, and performance evaluations and discusses future research directions. Moreover, the paper also discusses the basic building blocks and concepts behind LLMs, followed by a complete overview of LLMs, including their important features and functions. Finally, the paper summarizes significant findings from LLM research and consolidates essential architectural and training strategies for developing advanced LLMs. Given the continuous advancements in LLMs, we intend to regularly update this paper by incorporating new sections and featuring the latest LLM models.

Self-supervised learning, dubbed the dark matter of intelligence, is a promising path to advance machine learning. Yet, much like cooking, training SSL methods is a delicate art with a high barrier to entry. While many components are familiar, successfully training a SSL method involves a dizzying set of choices from the pretext tasks to training hyper-parameters. Our goal is to lower the barrier to entry into SSL research by laying the foundations and latest SSL recipes in the style of a cookbook. We hope to empower the curious researcher to navigate the terrain of methods, understand the role of the various knobs, and gain the know-how required to explore how delicious SSL can be.

This book develops an effective theory approach to understanding deep neural networks of practical relevance. Beginning from a first-principles component-level picture of networks, we explain how to determine an accurate description of the output of trained networks by solving layer-to-layer iteration equations and nonlinear learning dynamics. A main result is that the predictions of networks are described by nearly-Gaussian distributions, with the depth-to-width aspect ratio of the network controlling the deviations from the infinite-width Gaussian description. We explain how these effectively-deep networks learn nontrivial representations from training and more broadly analyze the mechanism of representation learning for nonlinear models. From a nearly-kernel-methods perspective, we find that the dependence of such models' predictions on the underlying learning algorithm can be expressed in a simple and universal way. To obtain these results, we develop the notion of representation group flow (RG flow) to characterize the propagation of signals through the network. By tuning networks to criticality, we give a practical solution to the exploding and vanishing gradient problem. We further explain how RG flow leads to near-universal behavior and lets us categorize networks built from different activation functions into universality classes. Altogether, we show that the depth-to-width ratio governs the effective model complexity of the ensemble of trained networks. By using information-theoretic techniques, we estimate the optimal aspect ratio at which we expect the network to be practically most useful and show how residual connections can be used to push this scale to arbitrary depths. With these tools, we can learn in detail about the inductive bias of architectures, hyperparameters, and optimizers.

We consider the problem of explaining the predictions of graph neural networks (GNNs), which otherwise are considered as black boxes. Existing methods invariably focus on explaining the importance of graph nodes or edges but ignore the substructures of graphs, which are more intuitive and human-intelligible. In this work, we propose a novel method, known as SubgraphX, to explain GNNs by identifying important subgraphs. Given a trained GNN model and an input graph, our SubgraphX explains its predictions by efficiently exploring different subgraphs with Monte Carlo tree search. To make the tree search more effective, we propose to use Shapley values as a measure of subgraph importance, which can also capture the interactions among different subgraphs. To expedite computations, we propose efficient approximation schemes to compute Shapley values for graph data. Our work represents the first attempt to explain GNNs via identifying subgraphs explicitly and directly. Experimental results show that our SubgraphX achieves significantly improved explanations, while keeping computations at a reasonable level.

Residual networks (ResNets) have displayed impressive results in pattern recognition and, recently, have garnered considerable theoretical interest due to a perceived link with neural ordinary differential equations (neural ODEs). This link relies on the convergence of network weights to a smooth function as the number of layers increases. We investigate the properties of weights trained by stochastic gradient descent and their scaling with network depth through detailed numerical experiments. We observe the existence of scaling regimes markedly different from those assumed in neural ODE literature. Depending on certain features of the network architecture, such as the smoothness of the activation function, one may obtain an alternative ODE limit, a stochastic differential equation or neither of these. These findings cast doubts on the validity of the neural ODE model as an adequate asymptotic description of deep ResNets and point to an alternative class of differential equations as a better description of the deep network limit.

We describe the new field of mathematical analysis of deep learning. This field emerged around a list of research questions that were not answered within the classical framework of learning theory. These questions concern: the outstanding generalization power of overparametrized neural networks, the role of depth in deep architectures, the apparent absence of the curse of dimensionality, the surprisingly successful optimization performance despite the non-convexity of the problem, understanding what features are learned, why deep architectures perform exceptionally well in physical problems, and which fine aspects of an architecture affect the behavior of a learning task in which way. We present an overview of modern approaches that yield partial answers to these questions. For selected approaches, we describe the main ideas in more detail.

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