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 implicit bias


The Rich and the Simple: On the Implicit Bias of Adam and SGD

Neural Information Processing Systems

Adam is the de facto optimization algorithm for several deep learning applications, but an understanding of its implicit bias and how it differs from other algorithms, particularly standard first-order methods such as (stochastic) gradient descent (GD), remains limited. In practice, neural networks (NNs) trained with SGD are known to exhibit simplicity bias -- a tendency to find simple solutions. In contrast, we show that Adam is more resistant to such simplicity bias. First, we investigate the differences in the implicit biases of Adam and GD when training two-layer ReLUNNs on a binary classification task with Gaussian data. We find that GD exhibits a simplicity bias, resulting in a linear decision boundary with a suboptimal margin, whereas Adam leads to much richer and more diverse features, producing a nonlinear boundary that is closer to the Bayes' optimal predictor. This richer decision boundary also allows Adam to achieve higher test accuracy both in-distribution and under certain distribution shifts. We theoretically prove these results by analyzing the population gradients. Next, to corroborate our theoretical findings, we present extensive empirical results showing that this property of Adam leads to superior generalization across various datasets with spurious correlations where NNs trained with SGD are known to show simplicity bias and do not generalize well under certain distributional shifts.


Adam Reduces a Unique Form of Sharpness: Theoretical Insights Near the Minimizer Manifold

Neural Information Processing Systems

Despite the popularity of the Adam optimizer in practice, most theoretical analyses study Stochastic Gradient Descent (SGD) as a proxy for Adam, and little is known about how the solutions found by Adam differ. In this paper, we show that Adam implicitly reduces a unique form of sharpness measure shaped by its adaptive updates, leading to qualitatively different solutions from SGD. More specifically, when the training loss is small, Adam wanders around the manifold of minimizers and takes semi-gradients to minimize this sharpness measure in an adaptive manner, a behavior we rigorously characterize through a continuous-time approximation using stochastic differential equations. We further demonstrate how this behavior differs from that of SGD in a well-studied setting: when training overparameterized models with label noise, SGD has been shown to minimize the trace of the Hessian matrix, tr(H), whereas we prove that Adam minimizes tr(Diag(H)1/2) instead. In solving sparse linear regression with diagonal linear networks, this distinction enables Adam to achieve better sparsity and generalization than SGD. Finally, our analysis framework extends beyond Adam to a broad class of adaptive gradient methods, including RMSProp, Adam-mini, Adalayer and Shampoo, and provides a unified perspective on how these adaptive optimizers reduce sharpness, which we hope will offer insights for future optimizer design.


The Implicit Bias of Steepest Descent with Mini-batch Stochastic Gradient

arXiv.org Machine Learning

A variety of widely used optimization methods like SignSGD and Muon can be interpreted as instances of steepest descent under different norm-induced geometries. In this work, we study the implicit bias of mini-batch stochastic steepest descent in multi-class classification, characterizing how batch size, momentum, and variance reduction shape the limiting max-margin behavior and convergence rates under general entry-wise and Schatten-$p$ norms. We show that, without momentum, worst-case convergence and successful classification can only be guaranteed with full-batch gradient. In contrast, momentum enables small-batch convergence to an approximate max-margin solution through a batch-momentum trade-off, though it slows convergence. This approach provides fully explicit, dimension-free rates that improve upon prior results. Moreover, we prove that variance reduction can recover the exact full-batch implicit bias for any batch size, albeit at a slower convergence rate. Finally, we further investigate the batch-size-one steepest descent without momentum, and reveal its convergence to a fundamentally different bias via a concrete data example, which reveals a key limitation of purely stochastic updates. Overall, our unified analysis clarifies when stochastic optimization aligns with full-batch behavior, and paves the way for perform deeper explorations of the training behavior of stochastic gradient steepest descent algorithms.


The Implicit Bias of Structured State Space Models Can Be Poisoned With Clean Labels

Neural Information Processing Systems

Neural networks are powered by an implicit bias: a tendency of gradient descent to fit training data in a way that generalizes to unseen data. A recent class of neural network models gaining increasing popularity is structured state space models (SSMs). Prior work argued that the implicit bias of SSMs leads to generalization in a setting where data is generated by a low dimensional teacher. In this paper, we revisit the latter setting, and formally establish a phenomenon entirely undetected by prior work on the implicit bias of SSMs. Namely, we prove that while implicit bias leads to generalization under many choices of training data, there exist special examples whose inclusion in training completely distorts the implicit bias, to a point where generalization fails. This failure occurs despite the special training examples being labeled by the teacher, i.e., having clean labels! We empirically demonstrate the phenomenon, with SSMs trained independently and as part of non-linear neural networks. In the area of adversarial machine learning, disrupting generalization with cleanly labeled training examples is known as clean-label poisoning. Given the proliferation of SSMs, we believe that delineating their susceptibility to clean-label poisoning, and developing methods for overcoming this susceptibility, are critical research directions to pursue.


Implicit Bias of Spectral Descent and Muon on Multiclass Separable Data

Neural Information Processing Systems

Different gradient-based methods for optimizing overparameterized models can all achieve zero training error yet converge to distinctly different solutions inducing different generalization properties. We provide the first complete characterization of implicit optimization bias for p-norm normalized steepest descent (NSD) and momentum steepest descent (NMD) algorithms in multi-class linear classification with cross-entropy loss. Our key theoretical contribution is proving that these algorithms converge to solutions maximizing the margin with respect to the classifier matrix's p-norm, with established convergence rates. These results encompass important special cases including Spectral Descent and Muon, which we show converge to max-margin solutions with respect to the spectral norm. A key insight of our contribution is that the analysis of general entry-wise and Schatten p-norms can be reduced to the analysis of NSD/NMD with max-norm by exploiting a natural ordering property between all p-norms relative to the max-norm and its dual sumnorm. For the specific case of descent with respect to the max-norm, we further extend our analysis to include preconditioning, showing that Adam converges to the matrix's max-norm solution. Our results demonstrate that the multi-class linear setting, which is inherently richer than the binary counterpart, provides the most transparent framework for studying implicit biases of matrix-parameter optimization algorithms.


The Implicit Bias of Structured State Space Models Can Be Poisoned With Clean Labels

Neural Information Processing Systems

Neural networks are powered by an implicit bias: a tendency of gradient descent to fit training data in a way that generalizes to unseen data. A recent class of neural network models gaining increasing popularity is structured state space models (SSMs). Prior work argued that the implicit bias of SSMs leads to generalization in a setting where data is generated by a low dimensional teacher. In this paper, we revisit the latter setting, and formally establish a phenomenon entirely undetected by prior work on the implicit bias of SSMs. Namely, we prove that while implicit bias leads to generalization under many choices of training data, there exist special examples whose inclusion in training completely distorts the implicit bias, to a point where generalization fails. This failure occurs despite the special training examples being labeled by the teacher, i.e., having clean labels! We empirically demonstrate the phenomenon, with SSMs trained independently and as part of non-linear neural networks. In the area of adversarial machine learning, disrupting generalization with cleanly labeled training examples is known as clean-label poisoning. Given the proliferation of SSMs, we believe that delineating their susceptibility to clean-label poisoning, and developing methods for overcoming this susceptibility, are critical research directions to pursue.


Estimating Implicit Regularization in Deep Learning

arXiv.org Machine Learning

Deep learning systems are known to exhibit implicit regularization (alt. implicit bias), favoring simple solutions instead of merely minimizing the loss function. In some cases, we can analytically derive the implicit regularization -- connecting it to an equivalent penalty that augments the learning objective. However, modern deep learning systems are complex, carrying modifications to the training procedure and architecture (e.g. early stopping, minibatching, dropout) whose effects are not always directly interpretable. Although estimating the resulting implicit regularization could aid theorists in algorithm design and practitioners in interpreting their hyperparameter choices, this problem has received little direct attention. It is also tractable: regularization makes weight updates deviate from loss gradients, promising a signal for identifying implicit bias. Here we provide gradient matching methods that can be used to empirically estimate the implicit regularization. Our method works on networks with known regularization, recovering popular explicit penalties like $\ell_1$ and $\ell_2$. It also replicates known implicit effects, like the quadratic weight penalty induced by early stopping in gradient descent, demonstrating that it can be used to test theories of implicit regularization. Crucially, because our method is empirical, it can handle implicit regularization in arbitrary networks. We demonstrate this use by characterizing the effects of dropout in deep networks, showing implicit $\ell_2$ effects in this popular method. Our work shows that practitioners can use gradient matching to understand regularization in networks with implicit biases that are too complicated to derive analytically.




Risk Bounds for Over-parameterized Maximum Margin Classification on Sub-Gaussian Mixtures

Neural Information Processing Systems

Modern machine learning systems such as deep neural networks are often highly over-parameterized so that they can fit the noisy training data exactly, yet they can still achieve small test errors in practice. In this paper, we study this "benign overfitting" phenomenon of the maximum margin classifier for linear classification problems. Specifically, we consider data generated from sub-Gaussian mixtures, and provide a tight risk bound for the maximum margin linear classifier in the over-parameterized setting. Our results precisely characterize the condition under which benign overfitting can occur in linear classification problems, and improve on previous work. They also have direct implications for over-parameterized logistic regression.