Search

Ubiquitous applications of Deep neural networks (DNNs) in different artificial intelligence systems have led to their adoption in solving challenging visualization problems in recent years. While sophisticated DNNs offer an impressive generalization, it is imperative to comprehend the quality, confidence, robustness, and uncertainty associated with their prediction. A thorough understanding of these quantities produces actionable insights that help application scientists make informed decisions. Unfortunately, the intrinsic design principles of the DNNs cannot beget prediction uncertainty, necessitating separate formulations for robust uncertainty-aware models for diverse visualization applications. To that end, this contribution demonstrates how the prediction uncertainty and sensitivity of DNNs can be estimated efficiently using various methods and then interactively compared and contrasted for deep image synthesis tasks. Our inspection suggests that uncertainty-aware deep visualization models generate illustrations of informative and superior quality and diversity. Furthermore, prediction uncertainty improves the robustness and interpretability of deep visualization models, making them practical and convenient for various scientific domains that thrive on visual analyses.

Stochastic Gradient Descent (SGD) stands as a cornerstone optimization algorithm with proven real-world empirical successes but relatively limited theoretical understanding. Recent research has illuminated a key factor contributing to its practical efficacy: the implicit regularization it instigates. Several studies have investigated the linear stability property of SGD in the vicinity of a stationary point as a predictive proxy for sharpness and generalization error in overparameterized neural networks (Wu et al., 2022; Jastrzebski et al., 2019; Cohen et al., 2021). In this paper, we delve deeper into the relationship between linear stability and sharpness. More specifically, we meticulously delineate the necessary and sufficient conditions for linear stability, contingent on hyperparameters of SGD and the sharpness at the optimum. Towards this end, we introduce a novel coherence measure of the loss Hessian that encapsulates pertinent geometric properties of the loss function that are relevant to the linear stability of SGD. It enables us to provide a simplified sufficient condition for identifying linear instability at an optimum. Notably, compared to previous works, our analysis relies on significantly milder assumptions and is applicable for a broader class of loss functions than known before, encompassing not only mean-squared error but also cross-entropy loss., Comment: To appear at ICLR 2024

With the rising popularity of Large Language Models (LLMs), there has been an increasing interest in compression techniques that enable their efficient deployment. This study focuses on the Post-Training Quantization (PTQ) of LLMs. Drawing from recent advances, our work introduces QuantEase, a layer-wise quantization framework where individual layers undergo separate quantization. The problem is framed as a discrete-structured non-convex optimization, prompting the development of algorithms rooted in Coordinate Descent (CD) techniques. These CD-based methods provide high-quality solutions to the complex non-convex layer-wise quantization problems. Notably, our CD-based approach features straightforward updates, relying solely on matrix and vector operations, circumventing the need for matrix inversion or decomposition. We also explore an outlier-aware variant of our approach, allowing for retaining significant weights (outliers) with complete precision. Our proposal attains state-of-the-art performance in terms of perplexity and zero-shot accuracy in empirical evaluations across various LLMs and datasets, with relative improvements up to 15% over methods such as GPTQ. Leveraging careful linear algebra optimizations, QuantEase can quantize models like Falcon-180B on a single NVIDIA A100 GPU in $\sim$3 hours. Particularly noteworthy is our outlier-aware algorithm's capability to achieve near or sub-3-bit quantization of LLMs with an acceptable drop in accuracy, obviating the need for non-uniform quantization or grouping techniques, improving upon methods such as SpQR by up to two times in terms of perplexity.

Modern deep learning models are over-parameterized, where different optima can result in widely varying generalization performance. The Sharpness-Aware Minimization (SAM) technique modifies the fundamental loss function that steers gradient descent methods toward flatter minima, which are believed to exhibit enhanced generalization prowess. Our study delves into a specific variant of SAM known as micro-batch SAM (mSAM). This variation involves aggregating updates derived from adversarial perturbations across multiple shards (micro-batches) of a mini-batch during training. We extend a recently developed and well-studied general framework for flatness analysis to theoretically show that SAM achieves flatter minima than SGD, and mSAM achieves even flatter minima than SAM. We provide a thorough empirical evaluation of various image classification and natural language processing tasks to substantiate this theoretical advancement. We also show that contrary to previous work, mSAM can be implemented in a flexible and parallelizable manner without significantly increasing computational costs. Our implementation of mSAM yields superior generalization performance across a wide range of tasks compared to SAM, further supporting our theoretical framework., Comment: arXiv admin note: substantial text overlap with arXiv:2212.04343

Modern deep learning models are over-parameterized, where the optimization setup strongly affects the generalization performance. A key element of reliable optimization for these systems is the modification of the loss function. Sharpness-Aware Minimization (SAM) modifies the underlying loss function to guide descent methods towards flatter minima, which arguably have better generalization abilities. In this paper, we focus on a variant of SAM known as mSAM, which, during training, averages the updates generated by adversarial perturbations across several disjoint shards of a mini-batch. Recent work suggests that mSAM can outperform SAM in terms of test accuracy. However, a comprehensive empirical study of mSAM is missing from the literature -- previous results have mostly been limited to specific architectures and datasets. To that end, this paper presents a thorough empirical evaluation of mSAM on various tasks and datasets. We provide a flexible implementation of mSAM and compare the generalization performance of mSAM to the performance of SAM and vanilla training on different image classification and natural language processing tasks. We also conduct careful experiments to understand the computational cost of training with mSAM, its sensitivity to hyperparameters and its correlation with the flatness of the loss landscape. Our analysis reveals that mSAM yields superior generalization performance and flatter minima, compared to SAM, across a wide range of tasks without significantly increasing computational costs.

Many tasks that rely on representations of nodes in graphs would benefit if those representations were faithful to distances between nodes in the graph. Geometric techniques to extract such representations have poor scaling over large graph size, and recent advances in Graph Neural Network (GNN) algorithms have limited ability to reflect graph distance information beyond the first degree neighborhood. To enable this highly desired capability, we propose a technique to learn Isometric Graph Neural Networks (IGNN), which requires changing the input representation space and loss function to enable any GNN algorithm to generate representations that reflect distances between nodes. We experiment with the isometric technique on several GNN architectures for modeling multiple prediction tasks on multiple datasets. In addition to an improvement in AUC-ROC as high as $43\%$ in these experiments, we observe a consistent and substantial improvement as high as 400% in Kendall's Tau (KT), a measure that directly reflects distance information, demonstrating that the learned embeddings do account for graph distances.

A gamma process dynamic Poisson factor analysis model is proposed to factorize a dynamic count matrix, whose columns are sequentially observed count vectors. The model builds a novel Markov chain that sends the latent gamma random variables at time $(t-1)$ as the shape parameters of those at time $t$, which are linked to observed or latent counts under the Poisson likelihood. The significant challenge of inferring the gamma shape parameters is fully addressed, using unique data augmentation and marginalization techniques for the negative binomial distribution. The same nonparametric Bayesian model also applies to the factorization of a dynamic binary matrix, via a Bernoulli-Poisson link that connects a binary observation to a latent count, with closed-form conditional posteriors for the latent counts and efficient computation for sparse observations. We apply the model to text and music analysis, with state-of-the-art results., Comment: Appeared in Artificial Intelligence and Statistics (AISTATS), May 2015. The ArXiv version fixes a typo in (8), the equation right above Section 3.2 in Page 4 of http://www.jmlr.org/proceedings/papers/v38/acharya15.pdf