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Understanding neural representations will help open the black box of neural networks and advance our scientific understanding of modern AI systems. However, how complex, structured, and transferable representations emerge in modern neural networks has remained a mystery. Building on previous results, we propose the Canonical Representation Hypothesis (CRH), which posits a set of six alignment relations to universally govern the formation of representations in most hidden layers of a neural network. Under the CRH, the latent representations (R), weights (W), and neuron gradients (G) become mutually aligned during training. This alignment implies that neural networks naturally learn compact representations, where neurons and weights are invariant to task-irrelevant transformations. We then show that the breaking of CRH leads to the emergence of reciprocal power-law relations between R, W, and G, which we refer to as the Polynomial Alignment Hypothesis (PAH). We present a minimal-assumption theory demonstrating that the balance between gradient noise and regularization is crucial for the emergence the canonical representation. The CRH and PAH lead to an exciting possibility of unifying major key deep learning phenomena, including neural collapse and the neural feature ansatz, in a single framework.more » « less
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Originally proposed for handling time series data, Auto-regressive Decision Trees (ARDTs) have not yet been explored for language modeling. This paper delves into both the theoretical and practical applications of ARDTs in this new context. We theoretically demonstrate that ARDTs can compute complex functions, such as simulating automata, Turing machines, and sparse circuits, by leveraging "chain-of-thought" computations. Our analysis provides bounds on the size, depth, and computational efficiency of ARDTs, highlighting their surprising computational power. Empirically, we train ARDTs on simple language generation tasks, showing that they can learn to generate coherent and grammatically correct text on par with a smaller Transformer model. Additionally, we show that ARDTs can be used on top of transformer representations to solve complex reasoning tasks. This research reveals the unique computational abilities of ARDTs, aiming to broaden the architectural diversity in language model development.more » « less
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It was always obvious that SGD with small minibatch size yields for neural networks much higher asymptotic fluctuations in the updates of the weight matrices than GD. It has also been often reported that SGD in deep RELU networks shows empirically a low-rank bias in the weight matrices. A recent theoretical analysis derived a bound on the rank and linked it to the size of the SGD fluctuations [25]. In this paper, we provide an empirical and theoretical analysis of the convergence of SGD vs GD, first for deep RELU networks and then for the case of linear regression, where sharper estimates can be obtained and which is of independent interest. In the linear case, we prove that the component $$W^\perp$$ of the matrix $$W$$ corresponding to the null space of the data matrix $$X$$ converges to zero for both SGD and GD, provided the regularization term is non-zero. Because of the larger number of updates required to go through all the training data, the convergence rate {\it per epoch} of these components is much faster for SGD than for GD. In practice, SGD has a much stronger bias than GD towards solutions for weight matrices $$W$$ with high fluctuations -- even when the choice of mini batches is deterministic -- and low rank, provided the initialization is from a random matrix. Thus SGD with non-zero regularization, shows the coupled phenomenon of asymptotic noise and a low-rank bias-- unlike GD.more » « less
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In this paper, we derive norm-based generalization bounds for sparse ReLU neural networks, including convolutional neural networks. These bounds differ from previous ones because they consider the sparse structure of the neural network architecture and the norms of the convolutional filters, rather than the norms of the (Toeplitz) matrices associated with the convolutional layers. Theoretically, we demonstrate that these bounds are significantly tighter than standard norm-based generalization bounds. Empirically, they offer relatively tight estimations of generalization for various simple classification problems. Collectively, these findings suggest that the sparsity of the underlying target function and the model’s architecture plays a crucial role in the success of deep learning.more » « less
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In this paper, we conduct an empirical study of the feature learning process in deep classifiers. Recent research has identified a training phenomenon called Neural Collapse (NC), in which the top-layer feature embeddings of samples from the same class tend to concentrate around their means, and the top layer’s weights align with those features. Our study aims to investigate if these properties extend to intermediate layers. We empirically study the evolution of the covariance and mean of representations across different layers and show that as we move deeper into a trained neural network, the within-class covariance decreases relative to the between-class covariance. Additionally, we find that in the top layers, where the between-class covariance is dominant, the subspace spanned by the class means aligns with the subspace spanned by the most significant singular vector components of the weight matrix in the corresponding layer. Finally, we discuss the relationship between NC and Associative Memories (Willshaw et al., 1969).more » « less
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In this paper, we study the bias of Stochastic Gradient Descent (SGD) to learn low-rank weight matrices when training deep ReLU neural networks. Our results show that training neural networks with mini-batch SGD and weight decay causes a bias towards rank minimization over the weight matrices. Specifically, we show, both theoretically and empirically, that this bias is more pronounced when using smaller batch sizes, higher learning rates, or increased weight decay. Additionally, we predict and observe empirically that weight decay is necessary to achieve this bias. Finally, we empirically investigate the connection between this bias and generalization, finding that it has a marginal effect on generalization. Our analysis is based on a minimal set of assumptions and applies to neural networks of any width or depth, including those with residual connections and convolutional layers.more » « less
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In this paper, we investigate the Rademacher complexity of deep sparse neural networks, where each neuron receives a small number of inputs. We prove generalization bounds for multilayered sparse ReLU neural networks, including convolutional neural networks. These bounds differ from previous ones, as they consider the norms of the convolutional filters instead of the norms of the associated Toeplitz matrices, independently of weight sharing between neurons. As we show theoretically, these bounds may be orders of magnitude better than standard norm-based generalization bounds and empirically, they are almost non-vacuous in estimating generalization in various simple classification problems. Taken together, these results suggest that compositional sparsity of the underlying target function is critical to the success of deep neural networks.more » « less
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We overview several properties—old and new—of training overparameterized deep networks under the square loss. We first consider a model of the dynamics of gradient flow under the square loss in deep homogeneous rectified linear unit networks. We study the convergence to a solution with the absolute minimumρ, which is the product of the Frobenius norms of each layer weight matrix, when normalization by Lagrange multipliers is used together with weight decay under different forms of gradient descent. A main property of the minimizers that bound their expected error for a specific network architecture isρ. In particular, we derive novel norm-based bounds for convolutional layers that are orders of magnitude better than classical bounds for dense networks. Next, we prove that quasi-interpolating solutions obtained by stochastic gradient descent in the presence of weight decay have a bias toward low-rank weight matrices, which should improve generalization. The same analysis predicts the existence of an inherent stochastic gradient descent noise for deep networks. In both cases, we verify our predictions experimentally. We then predict neural collapse and its properties without any specific assumption—unlike other published proofs. Our analysis supports the idea that the advantage of deep networks relative to other classifiers is greater for problems that are appropriate for sparse deep architectures such as convolutional neural networks. The reason is that compositionally sparse target functions can be approximated well by “sparse” deep networks without incurring in the curse of dimensionality.more » « less
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We overview several properties -- old and new -- of training overparametrized deep networks under the square loss. We first consider a model of the dynamics of gradient flow under the square loss in deep homogeneous ReLU networks. We study the convergence to a solution with the absolute minimum $$\rho$$, which is the product of the Frobenius norms of each layer weight matrix, when normalization by Lagrange multipliers (LM) is used together with Weight Decay (WD) under different forms of gradient descent. A main property of the minimizers that bounds their expected error {\it for a specific network architecture} is $$\rho$$. In particular, we derive novel norm-based bounds for convolutional layers that are orders of magnitude better than classical bounds for dense networks. Next we prove that quasi-interpolating solutions obtained by Stochastic Gradient Descent (SGD) in the presence of WD have a bias towards low rank weight matrices -- that, as we also explain, should improve generalization. The same analysis predicts the existence of an inherent SGD noise for deep networks. In both cases, we verify our predictions experimentally. We then predict Neural Collapse and its properties without any specific assumption -- unlike other published proofs. Our analysis supports the idea that the advantage of deep networks relative to other classifiers is greater for the problems that are appropriate for sparse deep architectures such as CNNs. The deep reason compositionally sparse target functions can be approximated well by ``sparse'' deep networks without incurring in the curse of dimensionality.more » « less
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We analyze deep ReLU neural networks trained with mini-batch stochastic gradient decent and weight decay. We prove that the source of the SGD noise is an implicit low rank constraint across all of the weight matrices within the network. Furthermore, we show, both theoretically and empirically, that when training a neural network using Stochastic Gradient Descent (SGD) with a small batch size, the resulting weight matrices are expected to be of small rank. Our analysis relies on a minimal set of assumptions and the neural networks may include convolutional layers, residual connections, as well as batch normalization layers.more » « less
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