77 accepted papers
The attention mechanism in Transformers is an important primitive for accurate and scalable sequence modeling. Its quadratic-compute and linear-memory complexity however remain significant bottlenecks. Linear attention and state-space models enable linear-time, constant-memory sequence modeling and…
Designing protein sequences that fold into a target 3-D structure, termed as the inverse folding problem, is central to protein engineering. However, it remains challenging due to the vast sequence space and the importance of local structural constraints. Existing deep learning approaches achieve st…
Recent vision-language models (VLMs) show strong reasoning capabilities through training with reinforcement learning from verifiable rewards (RLVR). Despite their impressive capabilities, current VLMs focus on a limited range of reasoning tasks, such as mathematical and logical reasoning, due to the
Playing video games requires perception, reasoning, memory, and long-horizon planning—exactly the faculties expected of modern large language and vision–language models (LLMs/VLMs). We introduce LMGame-Bench, a benchmark built on six popular games spanning platformer, puzzle, and narrative games thr…
Prevalent in biomedical applications (e.g., human phenotype research), multimodal datasets can provide valuable insights into the underlying physiological mechanisms. However, current machine learning (ML) models designed to analyze these datasets often lack interpretability and identifiability guar…
Optimizing data mixtures for supervised fine-tuning (SFT) of large language models (LLMs) is critical for developing general-purpose models, yet this area remains underexplored. In this paper, we frame data mixing as an optimization problem and introduce a novel method designed to minimize validatio…
Vector-Quantized Variational Autoencoders (VQVAEs) have enabled strong performance in generative modeling by mapping continuous data to learnable codes. In this work, we identify a surprising yet consistent phenomenon that we term \emph{dimensional collapse}: despite using high-dimensional embedding…
Modern language model (LM) training has been divided into multiple stages, making it difficult for downstream developers to evaluate the impact of design choices made at each stage. We present EvoLM, a model suite that enables systematic and transparent analysis of LMs' training dynamics across pre-…
Scaling video diffusion transformers (DiTs) is limited by their quadratic 3D attention, even though most of the attention mass concentrates on a small subset of positions. We turn this observation into VSA, a trainable, hardware-efficient sparse attention that replaces full attention at both traini…
Retrieval-Augmented Generation (RAG) improves pre-trained models by incorporating external knowledge at test time to enable customized adaptation. We study the risk of datastore leakage in Retrieval-In-Context RAG Language Models (LMs). We show that an adversary can exploit LMs' instruction-followi…
Concept learning seeks to extract semantic and interpretable representations of atomic concepts from high-dimensional data such as images and text, which can be instrumental to a variety of downstream tasks (e.g., image generation/editing). Despite its importance, the theoretical foundations for lea…
Language models can be steered by modifying their internal representations to control concepts such as emotion, style, or truthfulness in generation. However, the conditions for an effective intervention remain unclear and are often validated through heuristics and trial-and-error. To fill this gap,
Graph Neural Networks (GNNs) often encounter significant performance degradation under distribution shifts between training and test data, hindering their applicability in real-world scenarios. Recent studies have proposed various methods to address the out-of-distribution (OOD) generalization chall…
Reinforcement learning (RL) has shown promise in enhancing large language model (LLM) reasoning, yet progress towards broader capabilities is limited by the availability of high-quality, multi-domain datasets. This work introduces \ours, a 92K RL-for-reasoning dataset designed to address this gap, c…
Training large language models for long context understanding faces the challenge of data shortage. Previous data engineering approaches mechanically concatenate short documents, which may create many pseudo long documents but raise concerns about data quality. In this paper, we study the core attri…
Contrastive Language-Image Pre-training (CLIP) \citep radford2021learning has emerged as a pivotal model in computer vision and multimodal learning, achieving state-of-the-art performance at aligning visual and textual representations through contrastive learning. However, CLIP struggles with poten…
Synthetic data offers a promising path to train models while preserving data privacy. Differentially private (DP) finetuning of large language models (LLMs) as data generator is effective, but is impractical when computation resources are limited. Meanwhile, prompt-based methods such as private evol…
State-space models (SSMs) offer efficient alternatives to Transformers for long sequences, but their fixed-size recurrent state limits capability on algorithmic tasks, such as retrieving past context. In this work, we examine how in-context retrieval operates in Transformer- and SSM-based language m…
Large language models (LLMs) are trained on a vast amount of human-written data, but data providers often remain uncredited. In response to this issue, data valuation (or data attribution), which quantifies the contribution or value of each data to the model output, has been discussed as a potential…
We present scPilot, the first systematic framework to practice \textit{omics-native reasoning}: a large language model (LLM) converses in natural language while directly inspecting single-cell RNA-seq data and on-demand bioinformatics tools. scPilot converts core single-cell analyses, i.e., cell-typ…
Interpretable policy learning seeks to estimate intelligible decision policies from observed actions; however, existing models force a tradeoff between accuracy and interpretability, limiting data-driven interpretations of human decision-making processes. Fundamentally, existing approaches are burde…
Aligning Large Language Models (LLMs) traditionally relies on complex and costly training processes like supervised fine-tuning (SFT) and reinforcement learning from human feedback (RLHF). To address the challenge of achieving alignment without these extensive tuning costs and expensive annotations,…
The deployment of large language models (LLMs) is often constrained by memory bandwidth, where the primary bottleneck is the cost of transferring model parameters from the GPU’s global memory to its registers. When coupled with custom kernels that fuse the dequantization and matmul operations, weigh…
Learning concepts from natural high-dimensional data (e.g., images) holds potential in building human-aligned and interpretable machine learning models. Despite its encouraging prospect, formalization and theoretical insights into this crucial task are still lacking. In this work, we formali…
Large language models (LLMs) have gained considerable attention for their excellent natural language processing capabilities. Nonetheless, these LLMs present many challenges, particularly in the realm of trustworthiness. This paper introduces TrustLLM, a comprehensive study of trustworthiness in LLM…
Canonical work handling distribution shifts typically necessitates an entire target distribution that lands inside the training distribution. However, practical scenarios often involve only a handful target samples, potentially lying outside the training support, which requires the capability of ext…
Transformer architectures have become a dominant paradigm for domains like language modeling but suffer in many inference settings due to their quadratic-time self-attention. Recently proposed subquadratic architectures, such as Mamba, have shown promise, but have been pretrained with substantially…
The vast applications of deep generative models are anchored in three core capabilities---*generating* new instances, *reconstructing* inputs, and learning compact *representations*---across various data types, such as discrete text/protein sequences and continuous images. Existing model families, l…
Multimodal large language models (MLLMs) have shown impressive success across modalities such as image, video, and audio in a variety of understanding and generation tasks. However, current MLLMs are surprisingly poor at understanding webpage screenshots and generating their corresponding HTML cod…
Robust point cloud parsing under all-weather conditions is crucial to level-5 autonomy in autonomous driving. However, how to learn a universal 3D semantic segmentation (3DSS) model is largely neglected as most existing benchmarks are dominated by point clouds captured under normal weather. We intro…
Generative Adversarial Networks (GANs) rely heavily on large-scale training data for training high-quality image generation models. With limited training data, the GAN discriminator often suffers from severe overfitting which directly leads to degraded generation especially in generation diversity.…
3D style transfer aims to render stylized novel views of a 3D scene with multi-view consistency. However, most existing work suffers from a three-way dilemma over accurate geometry reconstruction, high-quality stylization, and being generalizable to arbitrary new styles. We propose StyleRF (Style Ra…
Masked autoencoder (MAE), a simple and effective self-supervised learning framework based on the reconstruction of masked image regions, has recently achieved prominent success in a variety of vision tasks. Despite the emergence of intriguing empirical observations on MAE, a theoretically principled…
The nonuniform quantization strategy for compressing neural networks usually achieves better performance than its counterpart, i.e., uniform strategy, due to its superior representational capacity. However, many nonuniform quantization methods overlook the complicated projection process in implement…
Training with an emphasis on "hard-to-learn" components of the data has been proven as an effective method to improve the generalization of machine learning models, especially in the settings where robustness (e.g., generalization across distributions) is valued. Existing literature discussing this…
Machine learning has demonstrated remarkable prediction accuracy over i.i.d data, but the accuracy often drops when tested with data from another distribution. In this paper, we aim to offer another view of this problem in a perspective assuming the reason behind this accuracy drop is the reliance o…
A fundamental challenge for machine learning models is generalizing to out-of-distribution (OOD) data, in part due to spurious correlations. To tackle this challenge, we first formalize the OOD generalization problem as constrained optimization, called Disentanglement-constrained Domain Generalizati…
This paper explores the feasibility of finding an optimal sub-model from a vision transformer and introduces a pure vision transformer slimming (ViT-Slim) framework. It can search a sub-structure from the original model end-to-end across multiple dimensions, including the input tokens, MHSA and MLP…
Synchronization is a key step in data-parallel distributed machine learning (ML). Different synchronization systems and strategies perform differently, and to achieve optimal parallel training throughput requires synchronization strategies that adapt to model structures and cluster configurations. E…
We investigate the relationship between the frequency spectrum of image data and the generalization behavior of convolutional neural networks (CNN). We first notice CNN's ability in capturing the high-frequency components of images. These high-frequency components are almost imperceptible to a human…
Despite success on a wide range of problems related to vision, generative adversarial networks (GANs) often suffer from inferior performance due to unstable training, especially for text generation. To solve this issue, we propose a new variational GAN training framework which enjoys superior train…
Most of the work on interpretable machine learning has focused on designing either inherently interpretable models, which typically trade-off accuracy for interpretability, or post-hoc explanation systems, whose explanation quality can be unpredictable. Our method, ExpO, is a hybridization of these…
Convolutional Neural Networks (CNN) conduct image classification by activating dominant features that correlated with labels. When the training and testing data are under similar distributions, their dominant features are similar, leading to decent test performance. The performance is nonetheless un…
Manipulating data, such as weighting data examples or augmenting with new instances, has been increasingly used to improve model training. Previous work has studied various rule- or learning-based approaches designed for specific types of data manipulation. In this work, we propose a new method that…
Despite their renowned in-domain predictive power, convolutional neural networks are known to rely more on high-frequency patterns that humans deem superficial than on low-frequency patterns that agree better with intuitions about what constitutes category membership. This paper proposes a method fo…
Despite impressive performance as evaluated on i.i.d. holdout data, deep neural networks depend heavily on superficial statistics of the training data and are liable to break under distribution shift. For example, subtle changes to the background or texture of an image can break a seemingly powerful…
Modern applications of machine learning (ML) deal with increasingly heterogeneous datasets comprised of data collected from overlapping latent subpopulations. As a result, traditional models trained over large datasets may fail to recognize highly predictive localized effects in favour of weakly pre…
Graph convolutional neural networks have recently shown great potential for the task of zero-shot learning. These models are highly sample efficient as related concepts in the graph structure share statistical strength allowing generalization to new classes when faced with a lack of data. However, m…
State-of-the-art approaches to causal discovery usually assume a fixed underlying causal model. However, it is often the case that causal models vary across domains or subjects, due to possibly omitted factors that affect the quantitative causal effects. As a typical example, causal connectivity in…
Estimating the structure of directed acyclic graphs (DAGs, also known as Bayesian networks) is a challenging problem since the search space of DAGs is combinatorial and scales superexponentially with the number of nodes. Existing approaches rely on various local heuristics for enforcing the acyclici…
The broad set of deep generative models (DGMs) has achieved remarkable advances. However, it is often difficult to incorporate rich structured domain knowledge with the end-to-end DGMs. Posterior regularization (PR) offers a principled framework to impose structured constraints on probabilistic mode…
Generating long and coherent reports to describe medical images poses challenges to bridging visual patterns with informative human linguistic descriptions. We propose a novel Hybrid Retrieval-Generation Reinforced Agent (HRGR-Agent) which reconciles traditional retrieval-based approaches populated…
As machine learning becomes more widely used in practice, we need new methods to build complex intelligent systems that integrate learning with existing software, and with domain knowledge encoded as rules. As a case study, we present such a system that learns to parse Newtonian physics problems in…
Bayesian Optimisation (BO) refers to a class of methods for global optimisation of a function f which is only accessible via point evaluations. It is typically used in settings where f is expensive to evaluate. A common use case for BO in machine learning is model selection, where it is not possible…
Deep generative models have achieved impressive success in recent years. Generative Adversarial Networks (GANs) and Variational Autoencoders (VAEs), as powerful frameworks for deep generative model learning, have largely been considered as two distinct paradigms and received extensive independent st…
Beyond local convolution networks, we explore how to harness various external human knowledge for endowing the networks with the capability of semantic global reasoning. Rather than using separate graphical models (e.g. CRF) or constraints for modeling broader dependencies, we propose a new Symbolic…
We study the sample complexity of semi-supervised learning (SSL) and introduce new assumptions based on the mismatch between a mixture model learned from unlabeled data and the true mixture model induced by the (unknown) class conditional distributions. Under these assumptions, we establish an $\Ome…
Binary classifiers are employed as discriminators in GAN-based unsupervised style transfer models to ensure that transferred sentences are similar to sentences in the target domain. One difficulty with the binary discriminator is that error signal is sometimes insufficient to train the model to prod…
We study large-scale multi-label classification (MLC) on two recently released datasets: Youtube-8M and Open Images that contain millions of data instances and thousands of classes. The unprecedented problem scale poses great challenges for MLC. First, finding out the correct label subset out of exp…
Despite progress in visual perception tasks such as image classification and detection, computers still struggle to understand the interdependency of objects in the scene as a whole, e.g., relations between objects or their attributes. Existing methods often ignore global context cues capturing the…
Future frame prediction in videos is a promising avenue for unsupervised video representation learning. Video frames are naturally generated by the inherent pixel flows from preceding frames based on the appearance and motion dynamics in the video. However, existing methods focus on directly halluci…
We consider learning a distance metric in a weakly supervised setting where "bags" (or sets) of instances are labeled with "bags" of labels. A general approach is to formulate the problem as a Multiple Instance Learning (MIL) problem where the metric is learned so that the distances between instance…
This paper develops a general framework for learning interpretable data representation via Long Short-Term Memory (LSTM) recurrent neural networks over hierarchal graph structures. Instead of learning LSTM models over the pre-fixed structures, we propose to further learn the intermediate interpretab…
The large model capacity of latent space models (LSMs) enables them to achieve great performance on various applications, but meanwhile renders LSMs to be prone to overfitting. Several recent studies investigate a new type of regularization approach, which encourages components in LSMs to be diverse…
The recently developed variational autoencoders (VAEs) have proved to be an effective confluence of the rich representational power of neural networks with Bayesian methods. However, most work on VAEs use a rather simple prior over the latent variables such as standard normal distribution, thereby r…
A natural image usually conveys rich semantic content and can be viewed from different angles. Existing image description methods are largely restricted by small sets of biased visual paragraph annotations, and fail to cover rich underlying semantics. In this paper, we investigate a semi-supervised…
We study the problem of conditional generative modeling based on designated semantics or structures. Existing models that build conditional generators either require massive labeled instances as supervision or are unable to accurately control the semantics of generated samples. We propose structured…
Generic generation and manipulation of text is challenging and has limited success compared to recent deep generative modeling in visual domain. This paper aims at generating plausible text sentences, whose attributes are controlled by learning disentangled latent representations with designated sem…
Latent space models (LSMs) provide a principled and effective way to extract hidden patterns from observed data. To cope with two challenges in LSMs: (1) how to capture infrequent patterns when pattern frequency is imbalanced and (2) how to reduce model size without sacrificing their expressiveness,…
Kernel methods are ubiquitous tools in machine learning. They have proven to be effective in many domains and tasks. Yet, kernel methods often require the user to select a predefined kernel to build an estimator with. However, there is often little reason for the common practice of selecting a kerne…
Clustering is the task of grouping a set of objects so that objects in the same cluster are more similar to each other than to those in other clusters. The crucial step in most clustering algorithms is to find an appropriate similarity metric, which is both challenging and problem-dependent. Supervi…
We introduce scalable deep kernels, which combine the structural properties of deep learning architectures with the non-parametric flexibility of kernel methods. Specifically, we transform the inputs of a spectral mixture base kernel with a deep architecture, using local kernel interpolation, induc…
Recently, there has been a surge of interest in using spectral methods for estimating latent variable models. However, it is usually assumed that the distribution of the observations conditioned on the latent variables is either discrete or belongs to a parametric family. In this paper, we study the…
Deep kernel learning combines the non-parametric flexibility of kernel methods with the inductive biases of deep learning architectures. We propose a novel deep kernel learning model and stochastic variational inference procedure which generalizes deep kernel learning approaches to enable classifica…
Complex event detection on unconstrained Internet videos has seen much progress in recent years. However, state-of-the-art performance degrades dramatically when the number of positive training exemplars falls short. Since label acquisition is costly, laborious, and time-consuming, there is a real n…
Stochastic gradient-based Monte Carlo methods such as stochastic gradient Langevin dynamics are useful tools for posterior inference on large scale datasets in many machine learning applications. These methods scale to large datasets by using noisy gradients calculated using a mini-batch or subset o…
Bayesian nonparametric models, such as Gaussian processes, provide a compelling framework for automatic statistical modelling: these models have a high degree of flexibility, and automatically calibrated complexity. However, automating human expertise remains elusive; for example, Gaussian processe…