mtybilly/Instruct2DS huggingface dataset:
Are Uncertainty Quantification Capabilities of Evidential Deep Learning a Mirage?
Authors: Maohao Shen, J. Jon Ryu, Soumya Ghosh, Yuheng Bu, Prasanna Sattigeri, Subhro Das, Gregory W. Wornell
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: This paper questions the effectiveness of a modern predictive uncertainty quantification approach, called evidential deep learning (EDL), in which a single neural network model is trained to learn a meta distribution over the predictive distribution by minimizing a specific objective function. Despite their perceived strong empirical performance on downstream tasks, a line of recent studies by Bengs et al. identify limitations of the existing methods to conclude their learned epistemic uncertainties are unreliable, e.g., in that they are non-vanishing even with infinite data. Building on and sharpening such analysis, we 1) provide a sharper understanding of the asymptotic behavior of a wide class of EDL methods by unifying various objective functions; 2) reveal that the EDL methods can be better interpreted as an out-of-distribution detection algorithm based on energy-based-models; and  3) conduct extensive ablation studies to better assess their empirical effectiveness with real-world datasets. Through all these analyses, we conclude that even when EDL methods are empirically effective on downstream tasks, this occurs despite their poor uncertainty quantification capabilities. Our investigation suggests that incorporating model uncertainty can help EDL methods faithfully quantify uncertainties and further improve performance on representative downstream tasks, albeit at the cost of additional computational complexity.
D-MiSo: Editing Dynamic 3D Scenes using Multi-Gaussians Soup
Authors: Joanna Waczyńska, Piotr Borycki, Joanna Kaleta, Sławomir Tadeja, Przemysław Spurek
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Over the past years, we have observed an abundance of approaches for modeling dynamic 3D scenes using Gaussian Splatting (GS). These solutions use GS to represent the scene's structure and the neural network to model dynamics. Such approaches allow fast rendering and extracting each element of such a dynamic scene. However, modifying such objects over time is challenging. SC-GS (Sparse Controlled Gaussian Splatting) enhanced with Deformed Control Points partially solves this issue. However, this approach necessitates selecting elements that need to be kept fixed, as well as centroids that should be adjusted throughout editing. Moreover, this task poses additional difficulties regarding the re-productivity of such editing. To address this, we propose Dynamic Multi-Gaussian Soup (D-MiSo), which allows us to model the mesh-inspired representation of dynamic GS. Additionally, we propose a strategy of linking parameterized Gaussian splats, forming a Triangle Soup with the estimated mesh. Consequently, we can separately construct new trajectories for the 3D objects composing the scene. Thus, we can make the scene's dynamic editable over time or while maintaining partial dynamics.
Compositional PAC-Bayes: Generalization of GNNs with persistence and beyond
Authors: Kirill Brilliantov, Amauri H. Souza, Vikas Garg
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Heterogeneity, e.g., due to different types of layers or multiple sub-models, poses key challenges in analyzing the generalization behavior of several modern architectures. For instance, descriptors based on Persistent Homology (PH) are being increasingly integrated into Graph Neural Networks (GNNs) to augment them with rich topological features; however, the generalization of such PH schemes remains unexplored. We introduce a novel compositional PAC-Bayes framework that provides a general recipe to analyze a broad spectrum of models including those with heterogeneous layers. Specifically, we provide the first data-dependent generalization bounds for a widely adopted PH vectorization scheme (that subsumes persistence landscapes, images, and silhouettes) as well as PH-augmented GNNs. Using our framework, we also obtain bounds for GNNs and neural nets with ease. Our bounds also inform the design of novel regularizers. Empirical evaluations on several standard real-world datasets demonstrate that our theoretical bounds highly correlate with empirical generalization performance, leading to improved classifier design via our regularizers. Overall, this work bridges a crucial gap in the theoretical understanding of PH methods and general heterogeneous models, paving the way for the design of better models for (graph) representation learning. Our code is available at https://github.com/Aalto-QuML/Compositional-PAC-Bayes.
Fast Channel Simulation via Error-Correcting Codes
Authors: Sharang M. Sriramu, Rochelle Barsz, Elizabeth Polito, Aaron B. Wagner
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: We consider the design of practically-implementable schemes for the task of channel simulation. Existing methods do not scale with the number of simultaneous uses of the channel and are therefore unable to harness the amortization gains associated with simulating many uses of the channel at once. We show how techniques from the theory of error-correcting codes can be applied to achieve scalability and hence improved performance. As an exemplar, we focus on how polar codes can be used to efficiently simulate i.i.d. copies of a class of binary-output channels.
Score-Optimal Diffusion Schedules
Authors: Christopher Williams, Andrew Campbell, Arnaud Doucet, Saifuddin Syed
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Denoising diffusion models (DDMs) offer a flexible framework for sampling from high dimensional data distributions. DDMs generate a path of probability distributions interpolating between a reference Gaussian distribution and a data distribution by incrementally injecting noise into the data. To numerically simulate the sampling process, a discretisation schedule from the reference back towards clean data must be chosen. An appropriate discretisation schedule is crucial to obtain high quality samples. However, beyond hand crafted heuristics, a general method for choosing this schedule remains elusive. This paper presents a novel algorithm for adaptively selecting an optimal discretisation schedule with respect to a cost that we derive. Our cost measures the work done by the simulation procedure to transport samples from one point in the diffusion path to the next. Our method does not require hyperparameter tuning and adapts to the dynamics and geometry of the diffusion path. Our algorithm only involves the evaluation of the estimated Stein score, making it scalable to existing pre-trained models at inference time and online during training. We find that our learned schedule recovers performant schedules previously only discovered through manual search and obtains competitive FID scores on image datasets.
YOLOv10: Real-Time End-to-End Object Detection
Authors: Ao Wang, Hui Chen, Lihao Liu, Kai Chen, Zijia Lin, Jungong Han, Guiguang Ding
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Over the past years, YOLOs have emerged as the predominant paradigm in the field of real-time object detection owing to their effective balance between computational cost and detection performance. Researchers have explored the architectural designs, optimization objectives, data augmentation strategies, and others for YOLOs, achieving notable progress. However, the reliance on the non-maximum suppression (NMS) for post-processing hampers the end-to-end deployment of YOLOs and adversely impacts the inference latency. Besides, the design of various components in YOLOs lacks the comprehensive and thorough inspection, resulting in noticeable computational redundancy and limiting the model's capability. It renders the suboptimal efficiency, along with considerable potential for performance improvements. In this work, we aim to further advance the performance-efficiency boundary of YOLOs from both the post-processing and the model architecture. To this end, we first present the consistent dual assignments for NMS-free training of YOLOs, which brings the competitive performance and low inference latency simultaneously. Moreover, we introduce the holistic efficiency-accuracy driven model design strategy for YOLOs. We comprehensively optimize various components of YOLOs from both the efficiency and accuracy perspectives, which greatly reduces the computational overhead and enhances the capability. The outcome of our effort is a new generation of YOLO series for real-time end-to-end object detection, dubbed YOLOv10. Extensive experiments show that YOLOv10 achieves the state-of-the-art performance and efficiency across various model scales. For example, our YOLOv10-S is 1.8$\times$ faster than RT-DETR-R18 under the similar AP on COCO, meanwhile enjoying 2.8$\times$ smaller number of parameters and FLOPs. Compared with YOLOv9-C, YOLOv10-B has 46\% less latency and 25\% fewer parameters for the same performance. Code and models are available at https://github.com/THU-MIG/yolov10.
Transformers Can Do Arithmetic with the Right Embeddings
Authors: Sean McLeish, Arpit Bansal, Alex Stein, Neel Jain, John Kirchenbauer, Brian R. Bartoldson, Bhavya Kailkhura, Abhinav Bhatele, Jonas Geiping, Avi Schwarzschild, Tom Goldstein
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: The poor performance of transformers on arithmetic tasks seems to stem in large part from their inability to keep track of the exact position of each digit inside of a large span of digits. We mend this problem by adding an embedding to each digit that encodes its position relative to the start of the number. In addition to the boost these embeddings provide on their own, we show that this fix enables architectural modifications such as input injection and recurrent layers to improve performance even further.With positions resolved, we can study the logical extrapolation ability of transformers. Can they solve arithmetic problems that are larger and more complex than those in their training data? We find that training on only 20 digit numbers with a single GPU for one day, we can reach state-of-the-art performance, achieving up to 99% accuracy on 100 digit addition problems. Finally, we show that these gains in numeracy also unlock improvements on other multi-step reasoning tasks including sorting and multiplication.
Consent in Crisis: The Rapid Decline of the AI Data Commons
Authors: Shayne Longpre, Robert Mahari, Ariel Lee, Campbell Lund, Hamidah Oderinwale, William Brannon, Nayan Saxena, Naana Obeng-Marnu, Tobin South, Cole Hunter, Kevin Klyman, Christopher Klamm, Hailey Schoelkopf, Nikhil Singh, Manuel Cherep, Ahmad Mustafa Anis, An Dinh, Caroline Chitongo, Da Yin, Damien Sileo, Deividas Mataciunas, Diganta Misra, Emad Alghamdi, Enrico Shippole, Jianguo Zhang, Joanna Materzynska, Kun Qian, Kush Tiwary, Lester Miranda, Manan Dey, Minnie Liang, Mohammed Hamdy, Niklas Muennighoff, Seonghyeon Ye, Seungone Kim, Shrestha Mohanty, Vipul Gupta, Vivek Sharma, Vu Minh Chien, Xuhui Zhou, Yizhi Li, Caiming Xiong, Luis Villa, Stella Biderman, Hanlin Li, Daphne Ippolito, Sara Hooker, Jad Kabbara, Sandy Pentland
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Datasets and Benchmarks Track), 2024

Abstract: General-purpose artificial intelligence (AI) systems are built on massive swathes of public web data, assembled into corpora such as C4, RefinedWeb, and Dolma. To our knowledge, we conduct the first, large-scale, longitudinal audit of the consent protocols for the web domains underlying AI training corpora. Our audit of 14,000 web domains provides an expansive view of crawlable web data and how codified data use preferences are changing over time. We observe a proliferation of AI-specific clauses to limit use, acute differences in restrictions on AI developers, as well as general inconsistencies between websites' expressed intentions in their Terms of Service and their robots.txt. We diagnose these as symptoms of ineffective web protocols, not designed to cope with the widespread re-purposing of the internet for AI. Our longitudinal analyses show that in a single year (2023-2024) there has been a rapid crescendo of data restrictions from web sources, rendering ~5\%+ of all tokens in C4, or 28%+ of the most actively maintained, critical sources in C4, fully restricted from use. For Terms of Service crawling restrictions, a full 45% of C4 is now restricted. If respected or enforced, these restrictions are rapidly biasing the diversity, freshness, and scaling laws for general-purpose AI systems. We hope to illustrate the emerging crises in data consent, for both developers and creators. The foreclosure of much of the open web will impact not only commercial AI, but also non-commercial AI and academic research.
Accelerating Nash Equilibrium Convergence in Monte Carlo Settings Through Counterfactual Value Based Fictitious Play
Authors: Ju Qi, Hei Falin, Feng Ting, Yi Dengbing, Fang Zhemei, Luo Yunfeng
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Counterfactual Regret Minimization (CFR) and its variants are widely recognized as effective algorithms for solving extensive-form imperfect information games. Recently, many improvements have been focused on enhancing the convergence speed of the CFR algorithm. However, most of these variants are not applicable under Monte Carlo (MC) conditions, making them unsuitable for training in large-scale games. We introduce a new MC-based algorithm for solving extensive-form imperfect information games, called MCCFVFP (Monte Carlo Counterfactual Value-Based Fictitious Play). MCCFVFP combines CFR’s counterfactual value calculations with fictitious play’s best response strategy, leveraging the strengths of fictitious play to gain significant advantages in games with a high proportion of dominated strategies. Experimental results show that MCCFVFP achieved convergence speeds approximately 20\%$\sim$50\% faster than the most advanced MCCFR variants in games like poker and other test games.
Image Textualization: An Automatic Framework for Generating Rich and Detailed Image Descriptions
Authors: Renjie Pi, Jianshu Zhang, Jipeng Zhang, Rui Pan, Zhekai Chen, Tong Zhang
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Datasets and Benchmarks Track), 2024

Abstract: Image description datasets play a crucial role in the advancement of various applications such as image understanding, text-to-image generation, and text-image retrieval. Currently, image description datasets primarily originate from two sources. One source is the scraping of image-text pairs from the web. Despite their abundance, these descriptions are often of low quality and noisy. Another way is through human labeling. Datasets such as COCO are generally very short and lack details. Although detailed image descriptions can be annotated by humans, the high cost limits their quantity and feasibility. These limitations underscore the need for more efficient and scalable methods to generate accurate and detailed image descriptions. In this paper, we propose an innovative framework termed Image Textualization, which automatically produces high-quality image descriptions by leveraging existing mult-modal large language models (MLLMs) and multiple vision expert models in a collaborative manner. We conduct various experiments to validate the high quality of the descriptions constructed by our framework. Furthermore, we show that MLLMs fine-tuned on our dataset acquire an unprecedented capability of generating richer image descriptions, substantially increasing the length and detail of their output with even less hallucinations.
Hierarchical Hybrid Sliced Wasserstein: A Scalable Metric for Heterogeneous Joint Distributions
Authors: Khai Nguyen, Nhat Ho
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Sliced Wasserstein (SW) and Generalized Sliced Wasserstein (GSW) have been widely used in applications due to their computational and statistical scalability. However, the SW and the GSW are only defined between distributions supported on a homogeneous domain. This limitation prevents their usage in applications with heterogeneous joint distributions with marginal distributions supported on multiple different domains. Using SW and GSW directly on the joint domains cannot make a meaningful comparison since their homogeneous slicing operator, i.e., Radon Transform (RT) and Generalized Radon Transform (GRT) are not expressive enough to capture the structure of the joint supports set. To address the issue, we propose two new slicing operators, i.e., Partial Generalized Radon Transform (PGRT) and Hierarchical Hybrid Radon Transform (HHRT). In greater detail, PGRT is the generalization of Partial Radon Transform (PRT), which transforms a subset of function arguments non-linearly while HHRT is the composition of PRT and multiple domain-specific PGRT on marginal domain arguments. By using HHRT, we extend the SW into Hierarchical Hybrid Sliced Wasserstein (H2SW) distance which is designed specifically for comparing heterogeneous joint distributions. We then discuss the topological, statistical, and computational properties of H2SW. Finally, we demonstrate the favorable performance of H2SW in 3D mesh deformation, deep 3D mesh autoencoders, and datasets comparison.
Optimistic Critic Reconstruction and Constrained Fine-Tuning for General Offline-to-Online RL
Authors: Qin-Wen Luo, Ming-Kun Xie, Ye-Wen Wang, Sheng-Jun Huang
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Offline-to-online (O2O) reinforcement learning (RL) provides an effective means of leveraging an offline pre-trained policy as initialization to improve performance rapidly with limited online interactions. Recent studies often design fine-tuning strategies for a specific offline RL method and cannot perform general O2O learning from any offline method. To deal with this problem, we disclose that there are evaluation and improvement mismatches between the offline dataset and the online environment, which hinders the direct application of pre-trained policies to online fine-tuning. In this paper, we propose to handle these two mismatches simultaneously, which aims to achieve general O2O learning from any offline method to any online method. Before online fine-tuning, we re-evaluate the pessimistic critic trained on the offline dataset in an optimistic way and then calibrate the misaligned critic with the reliable offline actor to avoid erroneous update. After obtaining an optimistic and and aligned critic, we perform constrained fine-tuning to combat distribution shift during online learning. We show empirically that the proposed method can achieve stable and efficient performance improvement on multiple simulated tasks when compared to the state-of-the-art methods.
Vision-Language Navigation with Energy-Based Policy
Authors: Rui Liu, Wenguan Wang, Yi Yang
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Vision-language navigation (VLN) requires an agent to execute actions following human instructions. Existing VLN models are optimized through expert demonstrations by supervised behavioural cloning or incorporating manual reward engineering. While straightforward, these efforts overlook the accumulation of errors in the Markov decision process, and struggle to match the distribution of the expert policy. Going beyond this, we propose an Energy-based Navigation Policy (ENP) to model the joint state-action distribution using an energy-based model. At each step, low energy values correspond to the state-action pairs that the expert is most likely to perform, and vice versa. Theoretically, the optimization objective is equivalent to minimizing the forward divergence between the occupancy measure of the expert and ours. Consequently, ENP learns to globally align with the expert policy by maximizing the likelihood of the actions and modeling the dynamics of the navigation states in a collaborative manner. With a variety of VLN architectures, ENP achieves promising performances on R2R, REVERIE, RxR, and R2R-CE, unleashing the power of existing VLN models.
The Elephant in the Room: Towards A Reliable Time-Series Anomaly Detection Benchmark
Authors: Qinghua Liu, John Paparrizos
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Datasets and Benchmarks Track), 2024

Abstract: Time-series anomaly detection is a fundamental task across scientific fields and industries. However, the field has long faced the ``elephant in the room:'' critical issues including flawed datasets, biased evaluation measures, and inconsistent benchmarking practices that have remained largely ignored and unaddressed.  We introduce the TSB-AD to systematically tackle these issues in the following three aspects: (i) Dataset Integrity: with 1070 high-quality time series from a diverse collection of 40 datasets (doubling the size of the largest collection and four times the number of existing curated datasets), we provide the first large-scale, heterogeneous, meticulously curated dataset that combines the effort of human perception and model interpretation; (ii) Measure Reliability: by revealing issues and biases in evaluation measures, we identify the most reliable and accurate measure, namely, VUS-PR for anomaly detection in time series to address concerns from the community; and (iii) Comprehensive Benchmarking: with a broad spectrum of 40 detection algorithms, from statistical methods to the latest foundation models, we perform a comprehensive evaluation that includes a thorough hyperparameter tuning and a unified setup for a fair and reproducible comparison. Our findings challenge the conventional wisdom regarding the superiority of advanced neural network architectures, revealing that simpler architectures and statistical methods often yield better performance. The promising performance of neural networks on multivariate cases and foundation models on point anomalies highlights the need for further advancements in these methods. We open-source the benchmark at https://github.com/TheDatumOrg/TSB-AD to promote further research.
The Limits of Transfer Reinforcement Learning with Latent Low-rank Structure
Authors: Tyler Sam, Yudong Chen, Christina Lee Yu
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Many reinforcement learning (RL) algorithms are too costly to use in practice due to the large sizes $S,A$ of the problem's state and action space. To resolve this issue, we study transfer RL with latent low rank structure. We consider the problem of transferring a latent low rank representation when the source and target MDPs have transition kernels with Tucker rank $(S, d, A)$, $(S ,S , d), (d, S , A )$, or $(d , d , d )$. In each setting, we introduce the transfer-ability coefficient $\alpha$ that measures the difficulty of representational transfer. Our algorithm learns latent representations in each source MDP and then exploits the linear structure to remove the dependence on $S , A $, or $SA $ in the target MDP regret bound. We complement our positive results with information theoretic lower bounds that show our algorithms (excluding the ($d, d, d$) setting) are minimax-optimal with respect to $\alpha$.
Deep Learning in Medical Image Registration: Magic or Mirage?
Authors: Rohit Jena, Deeksha Sethi, Pratik Chaudhari, James C. Gee
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Classical optimization and learning-based methods are the two reigning paradigms in deformable image registration. While optimization-based methods boast generalizability across modalities and robust performance, learning-based methods promise peak performance, incorporating weak supervision and amortized optimization. However, the exact conditions for either paradigm to perform well over the other are shrouded and not explicitly outlined in the existing literature. In this paper, we make an explicit correspondence between the mutual information of the distribution of per-pixel intensity and labels, and the performance of classical registration methods. This strong correlation hints to the fact that architectural designs in learning-based methods is unlikely to affect this correlation, and therefore, the performance of learning-based methods. This hypothesis is thoroughly validated with state-of-the-art classical and learning-based methods. However, learning-based methods with weak supervision can perform high-fidelity intensity and label registration, which is not possible with classical methods. Next, we show that this high-fidelity feature learning does not translate to invariance to domain shift, and learning-based methods are sensitive to such changes in the data distribution. We reassess and recalibrate performance expectations from classical and DLIR methods under access to label supervision, training time, and its generalization capabilities under minor domain shifts.
In-and-Out: Algorithmic Diffusion for Sampling Convex Bodies
Authors: Yunbum Kook, Santosh S. Vempala, Matthew S. Zhang
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: We present a new random walk for uniformly sampling high-dimensional convex bodies. It achieves state-of-the-art runtime complexity with stronger guarantees on the output than previously known, namely in Rényi divergence (which implies TV, $\mathcal{W}_2$, KL, $\chi^2$). The proof departs from known approaches for polytime algorithms for the problem - we utilize a stochastic diffusion perspective to show contraction to the target distribution with the rate of convergence determined by functional isoperimetric constants of the stationary density.
Memorize What Matters: Emergent Scene Decomposition from Multitraverse
Authors: Yiming Li, Zehong Wang, Yue Wang, Zhiding Yu, Zan Gojcic, Marco Pavone, Chen Feng, Jose M. Alvarez
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Humans naturally retain memories of permanent elements, while ephemeral moments often slip through the cracks of memory. This selective retention is crucial for robotic perception, localization, and mapping. To endow robots with this capability, we introduce 3D Gaussian Mapping (3DGM), a self-supervised, camera-only offline mapping framework grounded in 3D Gaussian Splatting. 3DGM converts multitraverse RGB videos from the same region into a Gaussian-based environmental map while concurrently performing 2D ephemeral object segmentation. Our key observation is that the environment remains consistent across traversals, while objects frequently change. This allows us to exploit self-supervision from repeated traversals to achieve environment-object decomposition. More specifically, 3DGM formulates multitraverse environmental mapping as a robust 3D representation learning problem, treating pixels of the environment and objects as inliers and outliers, respectively. Using robust feature distillation, feature residual mining, and robust optimization, 3DGM simultaneously performs 2D segmentation and 3D mapping without human intervention. We build the Mapverse benchmark, sourced from the Ithaca365 and nuPlan datasets, to evaluate our method in unsupervised 2D segmentation, 3D reconstruction, and neural rendering. Extensive results verify the effectiveness and potential of our method for self-driving and robotics.
Retrieval & Fine-Tuning for In-Context Tabular Models
Authors: Valentin Thomas, Junwei Ma, Rasa Hosseinzadeh, Keyvan Golestan, Guangwei Yu, Maksims Volkovs, Anthony Caterini
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Tabular data is a pervasive modality spanning a wide range of domains, and this inherent diversity poses a considerable challenge for deep learning. Recent advancements using transformer-based in-context learning have shown promise on smaller and less complex tabular datasets, but have struggled to scale to larger and more complex ones. To address this limitation, we propose a combination of retrieval and fine-tuning: we can adapt the transformer to a local subset of the data by collecting nearest neighbours, and then perform task-specific fine-tuning with this retrieved set of neighbours in context. Using TabPFN as the base model -- currently the best tabular in-context learner -- and applying our retrieval and fine-tuning scheme on top results in what we call a locally-calibrated PFN, or LoCalPFN. We conduct extensive evaluation on 95 datasets curated by TabZilla from OpenML, upon which we establish a new state-of-the-art with LoCalPFN -- even with respect to tuned tree-based models. Notably, we show a significant boost in performance compared to the base in-context model, demonstrating the efficacy of our approach and advancing the frontier of deep learning in tabular data.
The Minimax Rate of HSIC Estimation for Translation-Invariant Kernels
Authors: Florian Kalinke, Zoltán Szabó
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Kernel techniques are among the most influential approaches in data science and statistics. Under mild conditions, the reproducing kernel Hilbert space associated to a kernel is capable of encoding the independence of $M\ge2$ random variables. Probably the most widespread independence measure relying on kernels is the so-called Hilbert-Schmidt independence criterion (HSIC; also referred to as distance covariance in the statistics literature). Despite various existing HSIC estimators designed since its introduction close to two decades ago, the fundamental question of the rate at which HSIC can be estimated is still open. In this work, we prove that the minimax optimal rate of HSIC estimation on $\mathbb{R}^d$ for Borel measures containing the Gaussians with continuous bounded translation-invariant  characteristic  kernels  is $\mathcal{O}\left(n^{-1/2}\right)$. Specifically, our result implies the optimality in the minimax sense of many of the most-frequently used estimators (including the U-statistic, the V-statistic, and the Nyström-based one) on $\mathbb{R}^d$.
DDN: Dual-domain Dynamic Normalization for Non-stationary Time Series Forecasting
Authors: Tao Dai, Beiliang Wu, Peiyuan Liu, Naiqi Li, Xue Yuerong, Shu-Tao Xia, Zexuan Zhu
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Deep neural networks (DNNs) have recently achieved remarkable advancements in time series forecasting (TSF) due to their powerful ability of sequence dependence modeling. To date, existing DNN-based TSF methods still suffer from unreliable predictions for real-world data due to its non-stationarity characteristics, i.e., data distribution varies quickly over time. To mitigate this issue, several normalization methods (e.g., SAN) have recently been specifically designed by normalization in a fixed period/window in the time domain. However, these methods still struggle to capture distribution variations, due to the complex time patterns of time series in the time domain. Based on the fact that wavelet transform can decompose time series into a linear combination of different frequencies, which exhibits distribution variations with time-varying periods, we propose a novel Dual-domain Dynamic Normalization (DDN) to dynamically capture distribution variations in both time and frequency domains. Specifically, our DDN tries to eliminate the non-stationarity of time series via both frequency and time domain normalization in a sliding window way. Besides, our DDN can serve as a plug-in-play module, and thus can be easily incorporated into other forecasting models. Extensive experiments on public benchmark datasets under different forecasting models demonstrate the superiority of our DDN over other normalization methods. Code will be made available following the review process.
Active Set Ordering
Authors: Quoc Phong Nguyen, Sunil Gupta, Svetha Venkatesh, Bryan Kian Hsiang Low, Patrick Jaillet
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: In this paper, we formalize the active set ordering problem, which involves actively discovering a set of inputs based on their orderings determined by expensive evaluations of a blackbox function. We then propose the mean prediction (MP) algorithm and theoretically analyze it  in terms of the regret of predicted pairwise orderings between inputs. Notably, as a special case of this framework, we can cast Bayesian optimization as an active set ordering problem by recognizing that maximizers can be identified solely by comparison rather than by precisely estimating the function evaluations. As a result, we are able to construct the popular Gaussian process upper confidence bound (GP-UCB) algorithm through the lens of ordering with several nuanced insights. We empirically validate the performance of our proposed solution using various synthetic functions and real-world datasets.
Learning Elastic Costs to Shape Monge Displacements
Authors: Michal Klein, Aram-Alexandre Pooladian, Pierre Ablin, Eugène Ndiaye, Jonathan Niles-Weed, Marco Cuturi
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Given a source and a target probability measure, the Monge problem studies efficient ways to map the former onto the latter.This efficiency is quantified by defining a *cost* function between source and target data. Such a cost is often set by default in the machine learning literature to the squared-Euclidean distance, $\ell^2\_2(\mathbf{x},\mathbf{y}):=\tfrac12\|\mathbf{x}-\mathbf{y}\|\_2^2$.The benefits of using *elastic* costs, defined using a regularizer $\tau$ as $c(\mathbf{x},\mathbf{y}):=\ell^2_2(\mathbf{x},\mathbf{y})+\tau(\mathbf{x}-\mathbf{y})$, was recently highlighted in (Cuturi et al. 2023). Such costs shape the *displacements* of Monge maps $T$, namely the difference between a source point and its image $T(\mathbf{x})-\mathbf{x}$, by giving them a structure that matches that of the proximal operator of $\tau$.In this work, we make two important contributions to the study of elastic costs:*(i)* For any elastic cost, we propose a numerical method to compute Monge maps that are provably optimal. This provides a much-needed routine to create synthetic problems where the ground-truth OT map is known, by analogy to the Brenier theorem, which states that the gradient of any convex potential is always a valid Monge map for the $\ell_2^2$ cost; *(ii)* We propose a loss to *learn* the parameter $\theta$ of a parameterized regularizer $\tau_\theta$, and apply it in the case where $\tau_{A}({\bf z}):=\|A^\perp {\bf z}\|^2_2$. This regularizer promotes displacements that lie on a low-dimensional subspace of $\mathbb{R}^d$, spanned by the $p$ rows of $A\in\mathbb{R}^{p\times d}$. We illustrate the soundness of our procedure on synthetic data, generated using our first contribution, in which we show near-perfect recovery of $A$'s subspace using only samples. We demonstrate the applicability of this method by showing predictive improvements on single-cell data tasks.
Learning General Parameterized Policies for Infinite Horizon Average Reward Constrained MDPs via Primal-Dual Policy Gradient Algorithm
Authors: Qinbo Bai, Washim Uddin Mondal, Vaneet Aggarwal
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: This paper explores the realm of infinite horizon average reward Constrained Markov Decision Processes (CMDPs). To the best of our knowledge, this work is the first to delve into the regret and constraint violation analysis of average reward CMDPs with a general policy parametrization. To address this challenge, we propose a primal dual-based policy gradient algorithm that adeptly manages the constraints while ensuring a low regret guarantee toward achieving a global optimal policy. In particular, our proposed algorithm achieves $\tilde{\mathcal{O}}({T}^{4/5})$ objective regret and $\tilde{\mathcal{O}}({T}^{4/5})$ constraint violation bounds.
Neural decoding from stereotactic EEG: accounting for electrode variability across subjects
Authors: Georgios Mentzelopoulos, Evangelos Chatzipantazis, Ashwin G. Ramayya, Michelle J. Hedlund, Vivek P. Buch, Kostas Daniilidis, Konrad P. Kording, Flavia Vitale
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Deep learning based neural decoding from stereotactic electroencephalography (sEEG) would likely benefit from scaling up both dataset and model size. To achieve this, combining data across multiple subjects is crucial. However, in sEEG cohorts, each subject has a variable number of electrodes placed at distinct locations in their brain, solely based on clinical needs. Such heterogeneity in electrode number/placement poses a significant challenge for data integration, since there is no clear correspondence of the neural activity recorded at distinct sites between individuals. Here we introduce seegnificant: a training framework and architecture that can be used to decode behavior across subjects using sEEG data. We tokenize the neural activity within electrodes using convolutions and extract long-term temporal dependencies between tokens using self-attention in the time dimension. The 3D location of each electrode is then mixed with the tokens, followed by another self-attention in the electrode dimension to extract effective spatiotemporal neural representations. Subject-specific heads are then used for downstream decoding tasks. Using this approach, we construct a multi-subject model trained on the combined data from 21 subjects performing a behavioral task. We demonstrate that our model is able to decode the trial-wise response time of the subjects during the behavioral task solely from neural data. We also show that the neural representations learned by pretraining our model across individuals can be transferred in a few-shot manner to new subjects. This work introduces a scalable approach towards sEEG data integration for multi-subject model training, paving the way for cross-subject generalization for sEEG decoding.
CRT-Fusion: Camera, Radar, Temporal Fusion Using  Motion Information  for 3D Object Detection
Authors: Jisong Kim, Minjae Seong, Jun Won Choi
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Accurate and robust 3D object detection is a critical component in autonomous vehicles and robotics. While recent radar-camera fusion methods have made significant progress by fusing information in the bird's-eye view (BEV) representation, they often struggle to effectively capture the motion of dynamic objects, leading to limited performance in real-world scenarios. In this paper, we introduce CRT-Fusion, a novel framework that integrates temporal information into radar-camera fusion to address this challenge. Our approach comprises three key modules: Multi-View Fusion (MVF), Motion Feature Estimator (MFE), and Motion Guided Temporal Fusion (MGTF). The MVF module fuses radar and image features within both the camera view and bird's-eye view, thereby generating a more precise unified BEV representation. The MFE module conducts two simultaneous tasks: estimation of pixel-wise velocity information and BEV segmentation. Based on the velocity and the occupancy score map obtained from the MFE module, the MGTF module aligns and fuses feature maps across multiple timestamps in a recurrent manner. By considering the motion of dynamic objects, CRT-Fusion can produce robust BEV feature maps, thereby improving detection accuracy and robustness. Extensive evaluations on the challenging nuScenes dataset demonstrate that CRT-Fusion achieves state-of-the-art performance for radar-camera-based 3D object detection. Our approach outperforms the previous best method in terms of NDS by +1.7%, while also surpassing the leading approach in mAP by +1.4%. These significant improvements in both metrics showcase the effectiveness of our proposed fusion strategy in enhancing the reliability and accuracy of 3D object detection.
Transformation-Invariant Learning and Theoretical Guarantees for OOD Generalization
Authors: Omar Montasser, Han Shao, Emmanuel Abbe
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Learning with identical train and test distributions has been extensively investigated both practically and theoretically. Much remains to be understood, however, in statistical learning under distribution shifts. This paper focuses on a distribution shift setting where train and test distributions can be related by classes of (data) transformation maps. We initiate a theoretical study for this framework, investigating learning scenarios where the target class of transformations is either known or unknown. We establish learning rules and algorithmic reductions to Empirical Risk Minimization (ERM), accompanied with  learning guarantees. We obtain upper bounds on the sample complexity in terms of the VC dimension of the class composing predictors with transformations, which we show in many cases is not much larger than the VC dimension of the class of predictors. We highlight that the learning rules we derive offer a game-theoretic viewpoint on distribution shift: a learner searching for predictors and an adversary searching for transformation maps to respectively minimize and maximize the worst-case loss.
BetterDepth: Plug-and-Play Diffusion Refiner for Zero-Shot Monocular Depth Estimation
Authors: Xiang Zhang, Bingxin Ke, Hayko Riemenschneider, Nando Metzger, Anton Obukhov, Markus Gross, Konrad Schindler, Christopher Schroers
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: By training over large-scale datasets, zero-shot monocular depth estimation (MDE) methods show robust performance in the wild but often suffer from insufficient detail. Although recent diffusion-based MDE approaches exhibit a superior ability to extract details, they struggle in geometrically complex scenes that challenge their geometry prior, trained on less diverse 3D  data. To leverage the complementary merits of both worlds, we propose BetterDepth to achieve geometrically correct affine-invariant MDE while capturing fine details. Specifically, BetterDepth is a conditional diffusion-based refiner that takes the prediction from pre-trained MDE models as depth conditioning, in which the global depth layout is well-captured, and iteratively refines details based on the input image. For the training of such a refiner, we propose global pre-alignment and local patch masking methods to ensure BetterDepth remains faithful to the depth conditioning while learning to add fine-grained scene details. With efficient training on small-scale synthetic datasets, BetterDepth achieves state-of-the-art zero-shot MDE performance on diverse public datasets and on in-the-wild scenes. Moreover, BetterDepth can improve the performance of other MDE models in a plug-and-play manner without further re-training.
Temporal-Difference Learning Using Distributed Error Signals
Authors: Jonas Guan, Shon Eduard Verch, Claas Voelcker, Ethan C. Jackson, Nicolas Papernot, William A. Cunningham
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: A computational problem in biological reward-based learning is how credit assignment is performed in the nucleus accumbens (NAc). Much research suggests that NAc dopamine encodes temporal-difference (TD) errors for learning value predictions. However, dopamine is synchronously distributed in regionally homogeneous concentrations, which does not support explicit credit assignment (like used by backpropagation). It is unclear whether distributed errors alone are sufficient for synapses to make coordinated updates to learn complex, nonlinear reward-based learning tasks. We design a new deep Q-learning algorithm, Artificial Dopamine, to computationally demonstrate that synchronously distributed, per-layer TD errors may be sufficient to learn surprisingly complex RL tasks. We empirically evaluate our algorithm on MinAtar, the DeepMind Control Suite, and classic control tasks, and show it often achieves comparable performance to deep RL algorithms that use backpropagation.
MATES: Model-Aware Data Selection for Efficient Pretraining with Data Influence Models
Authors: Zichun Yu, Spandan Das, Chenyan Xiong
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: Pretraining data selection has the potential to improve language model pretraining efficiency by utilizing higher-quality data from massive web data corpora. Current data selection methods, which rely on either hand-crafted rules or larger reference models, are conducted statically and do not capture the evolving data preferences during pretraining. In this paper, we introduce model-aware data selection with data influence models (MATES), where a data influence model continuously adapts to the evolving data preferences of the pretraining model and then selects the data most effective for the current pretraining progress. Specifically, we collect oracle data influence by locally probing the pretraining model and fine-tune a small data influence model to approximate it accurately. The data influence model then predicts data influence over the whole pretraining corpus and selects the most influential data for the next pretraining stage. Experiments of pretraining 410M and 1B models on the C4 dataset demonstrate that MATES significantly outperforms random data selection on extensive downstream tasks. It doubles the gains achieved by the state-of-the-art data selection approach that leverages larger reference models and reduces the total FLOPs required to reach certain performances by half. Further analyses validate the effectiveness of the locally probed oracle data influence and the approximation with data influence models. Our code is open-sourced at https://github.com/cxcscmu/MATES.
Conformal Classification with Equalized Coverage for Adaptively Selected Groups
Authors: Yanfei Zhou, Matteo Sesia
Published in: Advances in Neural Information Processing Systems 37  (NeurIPS 2024) (Main Conference Track), 2024

Abstract: This paper introduces a conformal inference method to evaluate uncertainty in classification by generating prediction sets with valid coverage conditional on adaptively chosen features. These features are carefully selected to reflect potential model limitations or biases. This can be useful to find a practical compromise between efficiency---by providing informative predictions---and algorithmic fairness---by ensuring equalized coverage for the most sensitive groups. We demonstrate the validity and effectiveness of this method on simulated and real data sets.