Gradient descent (GD) type optimization schemes are the standard methods to train artificial neural networks (ANNs) with rectified linear unit (ReLU) activation. Such schemes can be considered as discretizations of gradient flows (GFs) associated to the training of ANNs with ReLU activation and most of the key difficulties in the mathematical convergence analysis of GD type optimization schemes in the training of ANNs with ReLU activation seem to be already present in the dynamics of the corresponding GF differential equations. It is the key subject of this work to analyze such GF differential equations in the training of ANNs with ReLU activation and three layers (one input layer, one hidden layer, and one output layer). In particular, in this article we prove in the case where the target function is possibly multi-dimensional and continuous and in the case where the probability distribution of the input data is absolutely continuous with respect to the Lebesgue measure that the risk of every bounded GF trajectory converges to the risk of a critical point. In addition, in this article we show in the case of a 1-dimensional affine linear target function and in the case where the probability distribution of the input data coincides with the standard uniform distribution that the risk of every bounded GF trajectory converges to zero if the initial risk is sufficiently small. Finally, in the special situation where there is only one neuron on the hidden layer (1-dimensional hidden layer) we strengthen the above named result for affine linear target functions by proving that that the risk of every (not necessarily bounded) GF trajectory converges to zero if the initial risk is sufficiently small.

Machine learning models often encounter distribution shifts when deployed in the real world. In this paper, we focus on adaptation to label distribution shift in the online setting, where the test-time label distribution is continually changing and the model must dynamically adapt to it without observing the true label. Leveraging a novel analysis, we show that the lack of true label does not hinder estimation of the expected test loss, which enables the reduction of online label shift adaptation to conventional online learning. Informed by this observation, we propose adaptation algorithms inspired by classical online learning techniques such as Follow The Leader (FTL) and Online Gradient Descent (OGD) and derive their regret bounds. We empirically verify our findings under both simulated and real world label distribution shifts and show that OGD is particularly effective and robust to a variety of challenging label shift scenarios.

Gradient descent is an optimization algorithm that follows the negative gradient of an objective function in order to locate the minimum of the function. A limitation of gradient descent is that it uses the same step size (learning rate) for each input variable. This can be a problem on objective functions that have different amounts of curvature in different dimensions, and in turn, may require a different sized step to a new point. Adaptive Gradients, or AdaGrad for short, is an extension of the gradient descent optimization algorithm that allows the step size in each dimension used by the optimization algorithm to be automatically adapted based on the gradients seen for the variable (partial derivatives) seen over the course of the search. In this tutorial, you will discover how to develop the gradient descent with adaptive gradients optimization algorithm from scratch.

This allows to search for architectures by using alternating stochastic gradient descent, which (in each batch) iterates While neural architecture search methods have been successful updates of the network parameters and the real-valued in previous years and led to new state-of-the-art performance weights parameterizing the architecture. However, directly on various problems, they have also been criticized using this alternating optimization has been reported to lead for being unstable, being highly sensitive with respect to premature convergence in the architectural space [26].

We establish an equivalence between the $\ell_2$-regularized solution path for a convex loss function, and the solution of an ordinary differentiable equation (ODE). Importantly, this equivalence reveals that the solution path can be viewed as the flow of a hybrid of gradient descent and Newton method applying to the empirical loss, which is similar to a widely used optimization technique called trust region method. This provides an interesting algorithmic view of $\ell_2$ regularization, and is in contrast to the conventional view that the $\ell_2$ regularization solution path is similar to the gradient flow of the empirical loss.New path-following algorithms based on homotopy methods and numerical ODE solvers are proposed to numerically approximate the solution path. In particular, we consider respectively Newton method and gradient descent method as the basis algorithm for the homotopy method, and establish their approximation error rates over the solution path. Importantly, our theory suggests novel schemes to choose grid points that guarantee an arbitrarily small suboptimality for the solution path. In terms of computational cost, we prove that in order to achieve an $\epsilon$-suboptimality for the entire solution path, the number of Newton steps required for the Newton method is $\mathcal O(\epsilon^{-1/2})$, while the number of gradient steps required for the gradient descent method is $\mathcal O\left(\epsilon^{-1} \ln(\epsilon^{-1})\right)$. Finally, we use $\ell_2$-regularized logistic regression as an illustrating example to demonstrate the effectiveness of the proposed path-following algorithms.

Network data are ubiquitous in modern machine learning, with tasks of interest including node classification, node clustering and link prediction. A frequent approach begins by learning an Euclidean embedding of the network, to which algorithms developed for vector-valued data are applied. For large networks, embeddings are learned using stochastic gradient methods where the sub-sampling scheme can be freely chosen. Despite the strong empirical performance of such methods, they are not well understood theoretically. Our work encapsulates representation methods using a subsampling approach, such as node2vec, into a single unifying framework. We prove, under the assumption that the graph is exchangeable, that the distribution of the learned embedding vectors asymptotically decouples. Moreover, we characterize the asymptotic distribution and provided rates of convergence, in terms of the latent parameters, which includes the choice of loss function and the embedding dimension. This provides a theoretical foundation to understand what the embedding vectors represent and how well these methods perform on downstream tasks. Notably, we observe that typically used loss functions may lead to shortcomings, such as a lack of Fisher consistency.

Despite the empirical success of deep learning, it still lacks theoretical understandings to explain why randomly initialized neural network trained by first-order optimization methods is able to achieve zero training loss, even though its landscape is non-convex and non-smooth. Recently, there are some works to demystifies this phenomenon under over-parameterized regime. In this work, we make further progress on this area by considering a commonly used momentum optimization algorithm: Nesterov accelerated method (NAG). We analyze the convergence of NAG for two-layer fully connected neural network with ReLU activation. Specifically, we prove that the error of NAG converges to zero at a linear convergence rate $1-\Theta(1/\sqrt{\kappa})$, where $\kappa > 1$ is determined by the initialization and the architecture of neural network. Comparing to the rate $1-\Theta(1/\kappa)$ of gradient descent, NAG achieves an acceleration. Besides, it also validates NAG and Heavy-ball method can achieve a similar convergence rate.

Transfer-based adversarial attacks can effectively evaluate model robustness in the black-box setting. Though several methods have demonstrated impressive transferability of untargeted adversarial examples, targeted adversarial transferability is still challenging. The existing methods either have low targeted transferability or sacrifice computational efficiency. In this paper, we develop a simple yet practical framework to efficiently craft targeted transfer-based adversarial examples. Specifically, we propose a conditional generative attacking model, which can generate the adversarial examples targeted at different classes by simply altering the class embedding and share a single backbone. Extensive experiments demonstrate that our method improves the success rates of targeted black-box attacks by a significant margin over the existing methods -- it reaches an average success rate of 29.6\% against six diverse models based only on one substitute white-box model in the standard testing of NeurIPS 2017 competition, which outperforms the state-of-the-art gradient-based attack methods (with an average success rate of $<$2\%) by a large margin. Moreover, the proposed method is also more efficient beyond an order of magnitude than gradient-based methods.

Successful applications of InfoNCE and its variants have popularized the use of contrastive variational mutual information (MI) estimators in machine learning. While featuring superior stability, these estimators crucially depend on costly large-batch training, and they sacrifice bound tightness for variance reduction. To overcome these limitations, we revisit the mathematics of popular variational MI bounds from the lens of unnormalized statistical modeling and convex optimization. Our investigation not only yields a new unified theoretical framework encompassing popular variational MI bounds but also leads to a novel, simple, and powerful contrastive MI estimator named as FLO. Theoretically, we show that the FLO estimator is tight, and it provably converges under stochastic gradient descent. Empirically, our FLO estimator overcomes the limitations of its predecessors and learns more efficiently. The utility of FLO is verified using an extensive set of benchmarks, which also reveals the trade-offs in practical MI estimation.

With the advent of big data acquisition technology, it has become increasingly important to integrate information across multiple datasets collected on a common set of subjects. Canonical correlation analysis (CCA), first proposed by Hotelling [20], is a widely used statistical tool to integrate information from two datasets: It seeks linear combinations of variables within each dataset such that their correlation is maximized. However, recent advances in fields such as multi-omics and multimodal brain imaging have presented us with new challenges, since scientists are often able to collect more than two datasets on the same set of subjects nowadays. To tackle these challenges, we turn to a useful generalization of CCA called generalized correlation analysis (GCA) [23] which aims to explore linear relationships across multiple data sources. Kettenring [23] proposed five different techniques for generalized correlation analysis of multiple datasets, where different methods correspond to maximization of different objective functions of covariances and correlations, subject to certain normalization constraints.