Chi-Heng Lin

Mehdi Azabou, Venkataramana Ganesh, Shantanu Thakoor et al. · gatech

Message passing neural networks have shown a lot of success on graph-structured data. However, there are many instances where message passing can lead to over-smoothing or fail when neighboring nodes belong to different classes. In this work, we introduce a simple yet general framework for improving learning in message passing neural networks. Our approach essentially upsamples edges in the original graph by adding "slow nodes" at each edge that can mediate communication between a source and a target node. Our method only modifies the input graph, making it plug-and-play and easy to use with existing models. To understand the benefits of slowing down message passing, we provide theoretical and empirical analyses. We report results on several supervised and self-supervised benchmarks, and show improvements across the board, notably in heterophilic conditions where adjacent nodes are more likely to have different labels. Finally, we show how our approach can be used to generate augmentations for self-supervised learning, where slow nodes are randomly introduced into different edges in the graph to generate multi-scale views with variable path lengths.

Jun-Kun Wang, Chi-Heng Lin, Andre Wibisono et al.

Heavy Ball (HB) nowadays is one of the most popular momentum methods in non-convex optimization. It has been widely observed that incorporating the Heavy Ball dynamic in gradient-based methods accelerates the training process of modern machine learning models. However, the progress on establishing its theoretical foundation of acceleration is apparently far behind its empirical success. Existing provable acceleration results are of the quadratic or close-to-quadratic functions, as the current techniques of showing HB's acceleration are limited to the case when the Hessian is fixed. In this work, we develop some new techniques that help show acceleration beyond quadratics, which is achieved by analyzing how the change of the Hessian at two consecutive time points affects the convergence speed. Based on our technical results, a class of Polyak-Łojasiewicz (PL) optimization problems for which provable acceleration can be achieved via HB is identified. Moreover, our analysis demonstrates a benefit of adaptively setting the momentum parameter. (Update: 08/29/2023) Erratum is added in Appendix J. This is an updated version that fixes an issue in the previous version. An additional condition needs to be satisfied for the acceleration result of HB beyond quadratics in this work, which naturally holds when the dimension is one or, more broadly, when the Hessian is diagonal. We elaborate on the issue in Appendix J.

Chi-Heng Lin, Chiraag Kaushik, Eva L. Dyer et al.

Data augmentation (DA) is a powerful workhorse for bolstering performance in modern machine learning. Specific augmentations like translations and scaling in computer vision are traditionally believed to improve generalization by generating new (artificial) data from the same distribution. However, this traditional viewpoint does not explain the success of prevalent augmentations in modern machine learning (e.g. randomized masking, cutout, mixup), that greatly alter the training data distribution. In this work, we develop a new theoretical framework to characterize the impact of a general class of DA on underparameterized and overparameterized linear model generalization. Our framework reveals that DA induces implicit spectral regularization through a combination of two distinct effects: a) manipulating the relative proportion of eigenvalues of the data covariance matrix in a training-data-dependent manner, and b) uniformly boosting the entire spectrum of the data covariance matrix through ridge regression. These effects, when applied to popular augmentations, give rise to a wide variety of phenomena, including discrepancies in generalization between over-parameterized and under-parameterized regimes and differences between regression and classification tasks. Our framework highlights the nuanced and sometimes surprising impacts of DA on generalization, and serves as a testbed for novel augmentation design.

Khiem Le, Youssef Mroueh, Phuc Nguyen et al.

Large language models trained via next-token prediction are fundamentally pattern-matchers: sensitive to superficial phrasing variations even when the underlying problem is identical. Group Relative Policy Optimization (GRPO) was designed to improve reasoning, but in fact it worsens this situation through two failure modes: diversity collapse, where training amplifies a single solution strategy while ignoring alternatives of gradient signal, and gradient diminishing, where a large portion of questions yield zero gradients because all rollouts receive identical rewards. We propose TA-GRPO (Transform-Augmented GRPO), which generates semantically equivalent transformed variants of each question (via paraphrasing, variable renaming, and format changes) and computes advantages by pooling rewards across the entire group. This pooled computation ensures mixed rewards even when the original question is too easy or too hard, while training on diverse phrasings promotes multiple solution strategies. We provide theoretical justification showing that TA-GRPO reduces zero-gradient probability and improves generalization via reduced train-test distribution shift. Experiments on mathematical reasoning benchmarks show consistent Pass@k improvements, with gains up to 9.84 points on competition math (AMC12, AIME24) and 5.05 points on out-of-distribution scientific reasoning (GPQA-Diamond).

Shikhar Tuli, Chi-Heng Lin, Yen-Chang Hsu et al.

Traditional language models operate autoregressively, i.e., they predict one token at a time. Rapid explosion in model sizes has resulted in high inference times. In this work, we propose DynaMo, a suite of multi-token prediction language models that reduce net inference times. Our models $\textit{dynamically}$ predict multiple tokens based on their confidence in the predicted joint probability distribution. We propose a lightweight technique to train these models, leveraging the weights of traditional autoregressive counterparts. Moreover, we propose novel ways to enhance the estimated joint probability to improve text generation quality, namely co-occurrence weighted masking and adaptive thresholding. We also propose systematic qualitative and quantitative methods to rigorously test the quality of generated text for non-autoregressive generation. One of the models in our suite, DynaMo-7.3B-T3, achieves same-quality generated text as the baseline (Pythia-6.9B) while achieving 2.57$\times$ speed-up with only 5.87% and 2.67% parameter and training time overheads, respectively.

Ran Liu, Mehdi Azabou, Max Dabagia et al.

Meaningful and simplified representations of neural activity can yield insights into how and what information is being processed within a neural circuit. However, without labels, finding representations that reveal the link between the brain and behavior can be challenging. Here, we introduce a novel unsupervised approach for learning disentangled representations of neural activity called Swap-VAE. Our approach combines a generative modeling framework with an instance-specific alignment loss that tries to maximize the representational similarity between transformed views of the input (brain state). These transformed (or augmented) views are created by dropping out neurons and jittering samples in time, which intuitively should lead the network to a representation that maintains both temporal consistency and invariance to the specific neurons used to represent the neural state. Through evaluations on both synthetic data and neural recordings from hundreds of neurons in different primate brains, we show that it is possible to build representations that disentangle neural datasets along relevant latent dimensions linked to behavior.

Jun-Kun Wang, Chi-Heng Lin, Jacob Abernethy

Stochastic gradient descent (SGD) with stochastic momentum is popular in nonconvex stochastic optimization and particularly for the training of deep neural networks. In standard SGD, parameters are updated by improving along the path of the gradient at the current iterate on a batch of examples, where the addition of a ``momentum'' term biases the update in the direction of the previous change in parameters. In non-stochastic convex optimization one can show that a momentum adjustment provably reduces convergence time in many settings, yet such results have been elusive in the stochastic and non-convex settings. At the same time, a widely-observed empirical phenomenon is that in training deep networks stochastic momentum appears to significantly improve convergence time, variants of it have flourished in the development of other popular update methods, e.g. ADAM [KB15], AMSGrad [RKK18], etc. Yet theoretical justification for the use of stochastic momentum has remained a significant open question. In this paper we propose an answer: stochastic momentum improves deep network training because it modifies SGD to escape saddle points faster and, consequently, to more quickly find a second order stationary point. Our theoretical results also shed light on the related question of how to choose the ideal momentum parameter--our analysis suggests that $β\in [0,1)$ should be large (close to 1), which comports with empirical findings. We also provide experimental findings that further validate these conclusions.

Mehdi Azabou, Mohammad Gheshlaghi Azar, Ran Liu et al.

State-of-the-art methods for self-supervised learning (SSL) build representations by maximizing the similarity between different transformed "views" of a sample. Without sufficient diversity in the transformations used to create views, however, it can be difficult to overcome nuisance variables in the data and build rich representations. This motivates the use of the dataset itself to find similar, yet distinct, samples to serve as views for one another. In this paper, we introduce Mine Your Own vieW (MYOW), a new approach for self-supervised learning that looks within the dataset to define diverse targets for prediction. The idea behind our approach is to actively mine views, finding samples that are neighbors in the representation space of the network, and then predict, from one sample's latent representation, the representation of a nearby sample. After showing the promise of MYOW on benchmarks used in computer vision, we highlight the power of this idea in a novel application in neuroscience where SSL has yet to be applied. When tested on multi-unit neural recordings, we find that MYOW outperforms other self-supervised approaches in all examples (in some cases by more than 10%), and often surpasses the supervised baseline. With MYOW, we show that it is possible to harness the diversity of the data to build rich views and leverage self-supervision in new domains where augmentations are limited or unknown.

Chi-Heng Lin, Mehdi Azabou, Eva L. Dyer

Optimal transport (OT) is a widely used technique for distribution alignment, with applications throughout the machine learning, graphics, and vision communities. Without any additional structural assumptions on trans-port, however, OT can be fragile to outliers or noise, especially in high dimensions. Here, we introduce a new form of structured OT that simultaneously learns low-dimensional structure in data while leveraging this structure to solve the alignment task. Compared with OT, the resulting transport plan has better structural interpretability, highlighting the connections between individual data points and local geometry, and is more robust to noise and sampling. We apply the method to synthetic as well as real datasets, where we show that our method can facilitate alignment in noisy settings and can be used to both correct and interpret domain shift.

Jun-Kun Wang, Chi-Heng Lin, Jacob Abernethy

Incorporating a so-called "momentum" dynamic in gradient descent methods is widely used in neural net training as it has been broadly observed that, at least empirically, it often leads to significantly faster convergence. At the same time, there are very few theoretical guarantees in the literature to explain this apparent acceleration effect. Even for the classical strongly convex quadratic problems, several existing results only show Polyak's momentum has an accelerated linear rate asymptotically. In this paper, we first revisit the quadratic problems and show a non-asymptotic accelerated linear rate of Polyak's momentum. Then, we provably show that Polyak's momentum achieves acceleration for training a one-layer wide ReLU network and a deep linear network, which are perhaps the two most popular canonical models for studying optimization and deep learning in the literature. Prior work Du at al. 2019 and Wu et al. 2019 showed that using vanilla gradient descent, and with an use of over-parameterization, the error decays as $(1- Θ(\frac{1}{ κ'}))^t$ after $t$ iterations, where $κ'$ is the condition number of a Gram Matrix. Our result shows that with the appropriate choice of parameters Polyak's momentum has a rate of $(1-Θ(\frac{1}{\sqrt{κ'}}))^t$. For the deep linear network, prior work Hu et al. 2020 showed that vanilla gradient descent has a rate of $(1-Θ(\frac{1}κ))^t$, where $κ$ is the condition number of a data matrix. Our result shows an acceleration rate $(1- Θ(\frac{1}{\sqrtκ}))^t$ is achievable by Polyak's momentum. All the results in this work are obtained from a modular analysis, which can be of independent interest. This work establishes that momentum does indeed speed up neural net training.

Chi-Heng Lin, Joseph D. Miano, Eva L. Dyer

Most existing black-box optimization methods assume that all variables in the system being optimized have equal cost and can change freely at each iteration. However, in many real world systems, inputs are passed through a sequence of different operations or modules, making variables in earlier stages of processing more costly to update. Such structure imposes a cost on switching variables in early parts of a data processing pipeline. In this work, we propose a new algorithm for switch cost-aware optimization called Lazy Modular Bayesian Optimization (LaMBO). This method efficiently identifies the global optimum while minimizing cost through a passive change of variables in early modules. The method is theoretical grounded and achieves vanishing regret when augmented with switching cost. We apply LaMBO to multiple synthetic functions and a three-stage image segmentation pipeline used in a neuroscience application, where we obtain promising improvements over prevailing cost-aware Bayesian optimization algorithms. Our results demonstrate that LaMBO is an effective strategy for black-box optimization that is capable of minimizing switching costs in modular systems.

Chi-Heng Lin, De-Nian Yang, Ji-Tang Lee et al.

With the emergence of naked-eye 3D mobile devices, mobile 3D video services are becoming increasingly important for video service providers, such as Youtube and Netflix, while multi-view 3D videos have the potential to inspire a variety of innovative applications. However, enabling multi-view 3D video services may overwhelm WiFi networks when every view of a video are multicasted. In this paper, therefore, we propose to incorporate depth-image-based rendering (DIBR), which allows each mobile client to synthesize the desired view from nearby left and right views, in order to effectively reduce the bandwidth consumption. Moreover, when each client suffers from packet losses, retransmissions incur additional bandwidth consumption and excess delay, which in turn undermines the quality of experience in video applications. To address the above issue, we first discover the merit of view protection via DIBR for multi-view video multicast using a mathematical analysis and then design a new protocol, named Multi-View Group Management Protocol (MVGMP), to support the dynamic join and leave of users and the change of desired views. The simulation results demonstrate that our protocol effectively reduces bandwidth consumption and increases the probability for each client to successfully playback the desired views in a multi-view 3D video.