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Register a new userA Local Convergence Theory for Mildly Over-Parameterized Two-Layer Neural Network
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While over-parameterization is widely believed to be crucial for the success of optimization for the neural networks, most existing theories on over-parameterization do not fully explain the reason -- they either work in the Neural Tangent Kernel regime where neurons dont move much, or require an enormous number of neurons. In practice, when the data is generated using a teacher neural network, even mildly over-parameterized neural networks can achieve 0 loss and recover the directions of teacher neurons. In this paper we develop a local convergence theory for mildly over-parameterized two-layer neural net. We show that as long as the loss is already lower than a threshold (polynomial in relevant parameters), all student neurons in an over-parameterized two-layer neural network will converge to one of teacher neurons, and the loss will go to 0. Our result holds for any number of student neurons as long as it is at least as large as the number of teacher neurons, and our convergence rate is independent of the number of student neurons. A key component of our analysis is the new characterization of local optimization landscape -- we show the gradient satisfies a special case of Lojasiewicz property which is different from local strong convexity or PL conditions used in previous work.
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We consider training over-parameterized two-layer neural networks with Rectified Linear Unit (ReLU) using gradient descent (GD) method. Inspired by a recent line of work, we study the evolutions of network prediction errors across GD iterations, which can be neatly described in a matrix form. When the network is sufficiently over-parameterized, these matrices individually approximate {em an} integral operator which is determined by the feature vector distribution $rho$ only. Consequently, GD method can be viewed as {em approximately} applying the powers of this integral operator on the underlying/target function $f^*$ that generates the responses/labels. We show that if $f^*$ admits a low-rank approximation with respect to the eigenspaces of this integral operator, then the empirical risk decreases to this low-rank approximation error at a linear rate which is determined by $f^*$ and $rho$ only, i.e., the rate is independent of the sample size $n$. Furthermore, if $f^*$ has zero low-rank approximation error, then, as long as the width of the neural network is $Omega(nlog n)$, the empirical risk decreases to $Theta(1/sqrt{n})$. To the best of our knowledge, this is the first result showing the sufficiency of nearly-linear network over-parameterization. We provide an application of our general results to the setting where $rho$ is the uniform distribution on the spheres and $f^*$ is a polynomial. Throughout this paper, we consider the scenario where the input dimension $d$ is fixed.
Nesterov SGD is widely used for training modern neural networks and other machine learning models. Yet, its advantages over SGD have not been theoretically clarified. Indeed, as we show in our paper, both theoretically and empirically, Nesterov SGD with any parameter selection does not in general provide acceleration over ordinary SGD. Furthermore, Nesterov SGD may diverge for step sizes that ensure convergence of ordinary SGD. This is in contrast to the classical results in the deterministic scenario, where the same step size ensures accelerated convergence of the Nesterovs method over optimal gradient descent. To address the non-acceleration issue, we introduce a compensation term to Nesterov SGD. The resulting algorithm, which we call MaSS, converges for same step sizes as SGD. We prove that MaSS obtains an accelerated convergence rates over SGD for any mini-batch size in the linear setting. For full batch, the convergence rate of MaSS matches the well-known accelerated rate of the Nesterovs method. We also analyze the practically important question of the dependence of the convergence rate and optimal hyper-parameters on the mini-batch size, demonstrating three distinct regimes: linear scaling, diminishing returns and saturation. Experimental evaluation of MaSS for several standard architectures of deep networks, including ResNet and convolutional networks, shows improved performance over SGD, Nesterov SGD and Adam.
We study the complexity of training neural network models with one hidden nonlinear activation layer and an output weighted sum layer. We analyze Gradient Descent applied to learning a bounded target function on $n$ real-valued inputs. We give an agnostic learning guarantee for GD: starting from a randomly initialized network, it converges in mean squared loss to the minimum error (in $2$-norm) of the best approximation of the target function using a polynomial of degree at most $k$. Moreover, for any $k$, the size of the network and number of iterations needed are both bounded by $n^{O(k)}log(1/epsilon)$. In particular, this applies to training networks of unbiased sigmoids and ReLUs. We also rigorously explain the empirical finding that gradient descent discovers lower frequency Fourier components before higher frequency components. We complement this result with nearly matching lower bounds in the Statistical Query model. GD fits well in the SQ framework since each training step is determined by an expectation over the input distribution. We show that any SQ algorithm that achieves significant improvement over a constant function with queries of tolerance some inverse polynomial in the input dimensionality $n$ must use $n^{Omega(k)}$ queries even when the target functions are restricted to a set of $n^{O(k)}$ degree-$k$ polynomials, and the input distribution is uniform over the unit sphere; for this class the information-theoretic lower bound is only $Theta(k log n)$. Our approach for both parts is based on spherical harmonics. We view gradient descent as an operator on the space of functions, and study its dynamics. An essential tool is the Funk-Hecke theorem, which explains the eigenfunctions of this operator in the case of the mean squared loss.
Deep neural networks (DNNs) have demonstrated dominating performance in many fields; since AlexNet, networks used in practice are going wider and deeper. On the theoretical side, a long line of works has been focusing on training neural networks with one hidden layer. The theory of multi-layer networks remains largely unsettled. In this work, we prove why stochastic gradient descent (SGD) can find $textit{global minima}$ on the training objective of DNNs in $textit{polynomial time}$. We only make two assumptions: the inputs are non-degenerate and the network is over-parameterized. The latter means the network width is sufficiently large: $textit{polynomial}$ in $L$, the number of layers and in $n$, the number of samples. Our key technique is to derive that, in a sufficiently large neighborhood of the random initialization, the optimization landscape is almost-convex and semi-smooth even with ReLU activations. This implies an equivalence between over-parameterized neural networks and neural tangent kernel (NTK) in the finite (and polynomial) width setting. As concrete examples, starting from randomly initialized weights, we prove that SGD can attain 100% training accuracy in classification tasks, or minimize regression loss in linear convergence speed, with running time polynomial in $n,L$. Our theory applies to the widely-used but non-smooth ReLU activation, and to any smooth and possibly non-convex loss functions. In terms of network architectures, our theory at least applies to fully-connected neural networks, convolutional neural networks (CNN), and residual neural networks (ResNet).
Formal verification of neural networks is essential for their deployment in safety-critical areas. Many available formal verification methods have been shown to be instances of a unified Branch and Bound (BaB) formulation. We propose a novel framework for designing an effective branching strategy for BaB. Specifically, we learn a graph neural network (GNN) to imitate the strong branching heuristic behaviour. Our framework differs from previous methods for learning to branch in two main aspects. Firstly, our framework directly treats the neural network we want to verify as a graph input for the GNN. Secondly, we develop an intuitive forward and backward embedding update schedule. Empirically, our framework achieves roughly $50%$ reduction in both the number of branches and the time required for verification on various convolutional networks when compared to the best available hand-designed branching strategy. In addition, we show that our GNN model enjoys both horizontal and vertical transferability. Horizontally, the model trained on easy properties performs well on properties of increased difficulty levels. Vertically, the model trained on small neural networks achieves similar performance on large neural networks.
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