Gradient Descent
When Are Solutions Connected in Deep Networks?
The question of how and why the phenomenon of mode connectivity occurs in training deep neural networks has gained remarkable attention in the research community. From a theoretical perspective, two possible explanations have been proposed: (i) the loss function has connected sublevel sets, and (ii) the solutions found by stochastic gradient descent are dropout stable. While these explanations provide insights into the phenomenon, their assumptions are not always satisfied in practice. In particular, the first approach requires the network to have one layer with order of N neurons ( N being the number of training samples), while the second one requires the loss to be almost invariant after removing half of the neurons at each layer (up to some rescaling of the remaining ones). In this work, we improve both conditions by exploiting the quality of the features at every intermediate layer together with a milder over-parameterization requirement.
(S)GD over Diagonal Linear Networks: Implicit bias, Large Stepsizes and Edge of Stability
In this paper, we investigate the impact of stochasticity and large stepsizes on the implicit regularisation of gradient descent (GD) and stochastic gradient descent (SGD) over 2 -layer diagonal linear networks. We prove the convergence of GD and SGD with macroscopic stepsizes in an overparametrised regression setting and characterise their solutions through an implicit regularisation problem. Our crisp characterisation leads to qualitative insights about the impact of stochasticity and stepsizes on the recovered solution. Specifically, we show that large stepsizes consistently benefit SGD for sparse regression problems, while they can hinder the recovery of sparse solutions for GD. These effects are magnified for stepsizes in a tight window just below the divergence threshold, in the edge of stability'' regime.
Tight Mutual Information Estimation With Contrastive Fenchel-Legendre Optimization
Successful applications of InfoNCE (Information Noise-Contrastive Estimation) 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 yields a new unified theoretical framework encompassing popular variational MI bounds, and leads to a novel, simple, and powerful contrastive MI estimator we name FLO. Theoretically, we show that the FLO estimator is tight, and it converges under stochastic gradient descent.
A Convergence Analysis of Gradient Descent on Graph Neural Networks
Graph Neural Networks (GNNs) are a powerful class of architectures for solving learning problems on graphs. While many variants of GNNs have been proposed in the literature and have achieved strong empirical performance, their theoretical properties are less well understood. In this work we study the convergence properties of the gradient descent algorithm when used to train GNNs. In particular, we consider the realizable setting where the data is generated from a network with unknown weights and our goal is to study conditions under which gradient descent on a GNN architecture can recover near optimal solutions. While such analysis has been performed in recent years for other architectures such as fully connected feed-forward networks, the message passing nature of the updates in a GNN poses a new challenge in understanding the nature of the gradient descent updates.
Simple Stochastic and Online Gradient Descent Algorithms for Pairwise Learning
Pairwise learning refers to learning tasks where the loss function depends on a pair of instances. A popular approach to handle streaming data in pairwise learning is an online gradient descent (OGD) algorithm, where one needs to pair the current instance with a buffering set of previous instances with a sufficiently large size and therefore suffers from a scalability issue. In this paper, we propose simple stochastic and online gradient descent methods for pairwise learning. A notable difference from the existing studies is that we only pair the current instance with the previous one in building a gradient direction, which is efficient in both the storage and computational complexity. We develop novel stability results, optimization, and generalization error bounds for both convex and nonconvex as well as both smooth and nonsmooth problems.
Dynamics of SGD with Stochastic Polyak Stepsizes: Truly Adaptive Variants and Convergence to Exact Solution
Recently Loizou et al. (2021), proposed and analyzed stochastic gradient descent (SGD) with stochastic Polyak stepsize (SPS). The proposed SPS comes with strong convergence guarantees and competitive performance; however, it has two main drawbacks when it is used in non-over-parameterized regimes: (i) It requires a priori knowledge of the optimal mini-batch losses, which are not available when the interpolation condition is not satisfied (e.g., regularized objectives), and (ii) it guarantees convergence only to a neighborhood of the solution. In this work, we study the dynamics and the convergence properties of SGD equipped with new variants of the stochastic Polyak stepsize and provide solutions to both drawbacks of the original SPS. We first show that a simple modification of the original SPS that uses lower bounds instead of the optimal function values can directly solve issue (i). On the other hand, solving issue (ii) turns out to be more challenging and leads us to valuable insights into the method's behavior.
Convergence and Alignment of Gradient Descent with Random Backpropagation Weights
Stochastic gradient descent with backpropagation is the workhorse of artificial neural networks. It has long been recognized that backpropagation fails to be a biologically plausible algorithm. Fundamentally, it is a non-local procedure---updating one neuron's synaptic weights requires knowledge of synaptic weights or receptive fields of downstream neurons. This limits the use of artificial neural networks as a tool for understanding the biological principles of information processing in the brain. Lillicrap et al. (2016) propose a more biologically plausible "feedback alignment" algorithm that uses random and fixed backpropagation weights, and show promising simulations.
Chaotic Regularization and Heavy-Tailed Limits for Deterministic Gradient Descent
Recent studies have shown that gradient descent (GD) can achieve improved generalization when its dynamics exhibits a chaotic behavior. However, to obtain the desired effect, the step-size should be chosen sufficiently large, a task which is problem dependent and can be difficult in practice. In this study, we incorporate a chaotic component to GD in a controlled manner, and introduce \emph{multiscale perturbed GD} (MPGD), a novel optimization framework where the GD recursion is augmented with chaotic perturbations that evolve via an independent dynamical system. We analyze MPGD from three different angles: (i) By building up on recent advances in rough paths theory, we show that, under appropriate assumptions, as the step-size decreases, the MPGD recursion converges weakly to a stochastic differential equation (SDE) driven by a heavy-tailed L\'{e}vy-stable process. Empirical results are provided to demonstrate the advantages of MPGD.
Stochastic Gradient Descent, Weighted Sampling, and the Randomized Kaczmarz algorithm
We improve a recent gurantee of Bach and Moulines on the linear convergence of SGD for smooth and strongly convex objectives, reducing a quadratic dependence on the strong convexity to a linear dependence. Furthermore, we show how reweighting the sampling distribution (i.e. Our results are based on a connection we make between SGD and the randomized Kaczmarz algorithm, which allows us to transfer ideas between the separate bodies of literature studying each of the two methods.
Three Operator Splitting with Subgradients, Stochastic Gradients, and Adaptive Learning Rates
Three Operator Splitting (TOS) (Davis & Yin, 2017) can minimize the sum of multiple convex functions effectively when an efficient gradient oracle or proximal operator is available for each term. This requirement often fails in machine learning applications: (i) instead of full gradients only stochastic gradients may be available; and (ii) instead of proximal operators, using subgradients to handle complex penalty functions may be more efficient and realistic. Motivated by these concerns, we analyze three potentially valuable extensions of TOS. The first two permit using subgradients and stochastic gradients, and are shown to ensure a \mathcal{O}(1/\sqrt{t}) convergence rate. We compare our proposed methods with competing methods on various applications.