mtybilly/Instruct2DS huggingface dataset:
Adjustable Robust Reinforcement Learning for Online 3D Bin Packing
Authors: Yize Chen, Fangzhen Lin Yuxin Pan
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: Designing effective policies for the online 3D bin packing problem (3D-BPP) has been a long-standing challenge, primarily due to the unpredictable nature of incoming box sequences and stringent physical constraints.  While current deep reinforcement learning (DRL) methods for online 3D-BPP have shown promising results in optimizing average performance over an underlying box sequence distribution, they often fail in real-world settings where some worst-case scenarios can materialize. Standard robust DRL algorithms tend to overly prioritize optimizing the worst-case performance at the expense of performance under normal problem instance distribution. To address these issues, we first introduce a permutation-based attacker to investigate the practical robustness of both DRL-based and heuristic methods proposed for solving online 3D-BPP. Then, we propose an adjustable robust reinforcement learning (AR2L) framework that allows efficient adjustment of robustness weights to achieve the desired balance of the policy's performance in average and worst-case environments. Specifically, we formulate the objective function as a weighted sum of expected and worst-case returns, and derive the lower performance bound  by relating to the return under a mixture dynamics. To realize this lower bound, we adopt an iterative procedure that searches for the associated mixture dynamics and improves the corresponding policy. We integrate this procedure into two popular robust adversarial algorithms to develop the exact and approximate AR2L algorithms. Experiments demonstrate that AR2L is versatile in the sense that it improves policy robustness while maintaining an acceptable level of performance for the nominal case.
Promises and Pitfalls of Threshold-based Auto-labeling
Authors: Heguang Lin, Frederic Sala, Ramya Korlakai Vinayak Harit Vishwakarma
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: Creating large-scale high-quality labeled datasets is a major bottleneck in supervised machine learning workflows. Threshold-based auto-labeling (TBAL), where validation data obtained from humans is used to find a confidence threshold above which the data is machine-labeled, reduces reliance on manual annotation. TBAL is emerging as a widely-used solution in practice. Given the long shelf-life and diverse usage of the resulting datasets, understanding when the data obtained by such auto-labeling systems can be relied on is crucial. This is the first work to analyze TBAL systems and derive sample complexity bounds on the amount of human-labeled validation data required for guaranteeing the quality of machine-labeled data. Our results provide two crucial insights. First, reasonable chunks of unlabeled data can be automatically and accurately labeled by seemingly bad models. Second, a hidden downside of TBAL systems is potentially prohibitive validation data usage. Together, these insights describe the promise and pitfalls of using such systems. We validate our theoretical guarantees with extensive experiments on synthetic and real datasets.
CAMEL: Communicative Agents for "Mind" Exploration of Large Language Model Society
Authors: Hasan Hammoud, Hani Itani, Dmitrii Khizbullin, Bernard Ghanem Guohao Li
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: The rapid advancement of chat-based language models has led to remarkable progress in complex task-solving. However, their success heavily relies on human input to guide the conversation, which can be challenging and time-consuming. This paper explores the potential of building scalable techniques to facilitate autonomous cooperation among communicative agents, and provides insight into their “cognitive” processes. To address the challenges of achieving autonomous cooperation, we propose a novel communicative agent framework named role-playing . Our approach involves using inception prompting to guide chat agents toward task completion while maintaining consistency with human intentions. We showcase how role-playing can be used to generate conversational data for studying the behaviors and capabilities of a society of agents, providing a valuable resource for investigating conversational language models. In particular, we conduct comprehensive studies on instruction-following cooperation in multi-agent settings. Our contributions include introducing a novel communicative agent framework, offering a scalable approach for studying the cooperative behaviors and capabilities of multi-agent systems, and open-sourcing our library to support research on communicative agents and beyond: https://github.com/camel-ai/camel.
Graph Neural Networks for Road Safety Modeling: Datasets and Evaluations for Accident Analysis
Authors: Dongyue Li, Haotian Ju, Haris Koutsopoulos, Hongyang Zhang Abhinav Nippani
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Datasets and Benchmarks Track), 2023

Abstract: We consider the problem of traffic accident analysis on a road network based on road network connections and traffic volume. Previous works have designed various deep-learning methods using historical records to predict traffic accident occurrences. However, there is a lack of consensus on how accurate existing methods are, and a fundamental issue is the lack of public accident datasets for comprehensive evaluations. This paper constructs a large-scale, unified dataset of traffic accident records from official reports of various states in the US, totaling 9 million records, accompanied by road networks and traffic volume reports. Using this new dataset, we evaluate existing deep-learning methods for predicting the occurrence of accidents on road networks. Our main finding is that graph neural networks such as GraphSAGE can accurately predict the number of accidents on roads with less than 22% mean absolute error (relative to the actual count) and whether an accident will occur or not with over 87% AUROC, averaged over states. We achieve these results by using multitask learning to account for cross-state variabilities (e.g., availability of accident labels) and transfer learning to combine traffic volume with accident prediction. Ablation studies highlight the importance of road graph-structural features, amongst other features. Lastly, we discuss the implications of the analysis and develop a package for easily using our new dataset.
SUBP: Soft Uniform Block Pruning for 1$\times$N Sparse CNNs Multithreading Acceleration
Authors: Siqi Li, Jun Chen, Guang Dai, Shipeng Bai, Yukai Ma, Yong Liu JINGYANG XIANG
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: The study of sparsity in Convolutional Neural Networks (CNNs) has become widespread to compress and accelerate models in environments with limited resources. By constraining N consecutive weights along the output channel to be group-wise non-zero, the recent network with 1$\times$N sparsity has received tremendous popularity for its three outstanding advantages: 1) A large amount of storage space saving by a \emph{Block Sparse Row} matrix. 2) Excellent performance at a high sparsity. 3) Significant speedups on CPUs with Advanced Vector Extensions. Recent work requires selecting and fine-tuning 1$\times$N sparse weights based on dense pre-trained weights, leading to the problems such as expensive training cost and memory access, sub-optimal model quality, as well as unbalanced workload across threads (different sparsity across output channels). To overcome them, this paper proposes a novel \emph{\textbf{S}oft \textbf{U}niform \textbf{B}lock \textbf{P}runing} (SUBP) approach to train a uniform 1$\times$N sparse structured network from scratch. Specifically, our approach tends to repeatedly allow pruned blocks to regrow to the network based on block angular redundancy and importance sampling in a uniform manner throughout the training process. It not only makes the model less dependent on pre-training, reduces the model redundancy and the risk of pruning the important blocks permanently but also achieves balanced workload. Empirically, on ImageNet, comprehensive experiments across various CNN architectures show that our SUBP consistently outperforms existing 1$\times$N and structured sparsity methods based on pre-trained models or training from scratch. Source codes and models are available at \url{https://github.com/JingyangXiang/SUBP}.
Adaptive Linear Estimating Equations
Authors: Koulik Khamaru, Cun-Hui Zhang Mufang Ying
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: Sequential data collection has emerged as a widely adopted technique for enhancing the efficiency of data gathering processes. Despite its advantages, such data collection mechanism often introduces complexities to the statistical inference procedure. For instance, the ordinary least squares (OLS) estimator in an adaptive linear regression model can exhibit non-normal asymptotic behavior, posing challenges for accurate inference and interpretation. In this paper, we propose a general method for constructing debiased estimator which remedies this issue. It makes use of the idea of adaptive linear estimating equations, and we establish theoretical guarantees of asymptotic normality, supplemented by discussions on achieving near-optimal asymptotic variance. A salient feature of our estimator is that in the context of multi-armed bandits,  our estimator retains the non-asymptotic performance of the least squares estimator while obtaining asymptotic normality property. Consequently, this work helps connect two fruitful paradigms of adaptive inference: a) non-asymptotic inference using concentration inequalities  and b) asymptotic inference via asymptotic normality.
Robust Knowledge Transfer in Tiered Reinforcement Learning
Authors: Niao He Jiawei Huang
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: In this paper, we study the Tiered Reinforcement Learning setting, a parallel transfer learning framework, where the goal is to transfer knowledge from the low-tier (source) task to the high-tier (target) task to reduce the exploration risk of the latter while solving the two tasks in parallel. Unlike previous work, we do not assume the low-tier and high-tier tasks share the same dynamics or reward functions, and focus on robust knowledge transfer without prior knowledge on the task similarity. We identify a natural and necessary condition called the ``Optimal Value Dominance'' for our objective. Under this condition, we propose novel online learning algorithms such that, for the high-tier task, it can achieve constant regret on partial states depending on the task similarity and retain near-optimal regret when the two tasks are dissimilar, while for the low-tier task, it can keep near-optimal without making sacrifice. Moreover, we further study the setting with multiple low-tier tasks, and propose a novel transfer source selection mechanism, which can ensemble the information from all low-tier tasks and allow provable benefits on a much larger state-action space.
Bypassing the Simulator: Near-Optimal Adversarial Linear Contextual Bandits
Authors: Chen-Yu Wei, Julian Zimmert Haolin Liu
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: We consider the adversarial linear contextual bandit problem, where the loss vectors are selected fully adversarially and the per-round action set (i.e. the context) is drawn from a fixed distribution. Existing methods for this problem either require access to a simulator to generate free i.i.d. contexts, achieve a sub-optimal regret no better than $\tilde{\mathcal{O}}(T^{\frac{5}{6}})$, or are computationally inefficient. We greatly improve these results by achieving a regret of $\tilde{\mathcal{O}}(\sqrt{T})$ without a simulator, while maintaining computational efficiency when the action set in each round is small. In the special case of sleeping bandits with adversarial loss and stochastic arm availability, our result answers affirmatively the open question by [SGV20]  on whether there exists a polynomial-time algorithm with  $poly(d)\sqrt{T}$ regret. Our approach naturally handles the case where the loss is linear up to an additive misspecification error, and our regret shows near-optimal dependence on the magnitude of the error.
GenEval: An object-focused framework for evaluating text-to-image alignment
Authors: Hannaneh Hajishirzi, Ludwig Schmidt Dhruba Ghosh
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Datasets and Benchmarks Track), 2023

Abstract: Recent breakthroughs in diffusion models, multimodal pretraining, and efficient finetuning have led to an explosion of text-to-image generative models. Given human evaluation is expensive and difficult to scale, automated methods are critical for evaluating the increasingly large number of new models. However, most current automated evaluation metrics like FID or CLIPScore only offer a distribution-level measure of image quality or image-text alignment, and are unsuited for fine-grained or instance-level analysis. In this paper, we introduce GenEval, an object-focused framework to evaluate compositional image properties such as object co-occurrence, position, count, and color. We show that current object detection models can be leveraged to evaluate text-to-image models on a variety of generation tasks with strong human agreement, and that other discriminative vision models can be linked to this pipeline to further verify properties like object color. We then evaluate several open-source text-to-image models and analyze their relative reasoning capabilities on our benchmark. We find that recent models demonstrate significant improvement on these tasks, though they are still lacking in complex capabilities such as spatial relations and attribute binding. Finally, we demonstrate how GenEval might be used to help discover existing failure modes, in order to inform development of the next generation of text-to-image models. Our code to run the GenEval framework will be made publicly available at https://github.com/djghosh13/geneval.
Generalization in the Face of Adaptivity: A Bayesian Perspective
Authors: Katrina Ligett Moshe Shenfeld
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: Repeated use of a data sample via adaptively chosen queries can rapidly lead to overfitting, wherein the empirical evaluation of queries on the sample significantly deviates from their mean with respect to the underlying data distribution. It turns out that simple noise addition algorithms suffice to prevent this issue, and differential privacy-based analysis of these algorithms shows that they can handle an asymptotically optimal number of queries.  However, differential privacy's worst-case nature entails scaling such noise to the range of the queries even for highly-concentrated queries, or introducing more complex algorithms.In this paper, we prove that straightforward noise-addition algorithms already provide variance-dependent guarantees that also extend to unbounded queries. This improvement stems from a novel characterization that illuminates the core problem of adaptive data analysis. We show that the harm of adaptivity results from the covariance between the new query and a Bayes factor-based measure of how much information about the data sample was encoded in the responses given to past queries. We then leverage this characterization to introduce a new data-dependent stability notion that can bound this covariance.
Convergence of Adam Under Relaxed Assumptions
Authors: Alexander Rakhlin, Ali Jadbabaie Haochuan Li
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: In this paper, we provide a rigorous proof of convergence of the Adaptive Moment Estimate (Adam) algorithm for a wide class of optimization objectives. Despite the popularity and efficiency of the Adam algorithm in training deep neural networks, its theoretical properties are not yet fully understood, and existing convergence proofs require unrealistically strong assumptions, such as globally bounded gradients, to show the convergence to stationary points. In this paper, we show that Adam provably converges to $\epsilon$-stationary points with $\mathcal{O}(\epsilon^{-4})$ gradient complexity under far more realistic conditions. The key to our analysis is a new proof of boundedness of gradients along the optimization trajectory of Adam, under a generalized smoothness assumption according to which the local smoothness (i.e., Hessian norm when it exists) is bounded by a sub-quadratic function of the gradient norm. Moreover, we propose a variance-reduced version of Adam with an accelerated gradient complexity of $\mathcal{O}(\epsilon^{-3})$.
On the Convergence of Encoder-only Shallow Transformers
Authors: Fanghui Liu, Grigorios Chrysos, Volkan Cevher Yongtao Wu
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: In this paper, we aim to build the global convergence theory of encoder-only shallow Transformers under a realistic setting from the perspective of architectures, initialization, and scaling under a finite width regime. The difficulty lies in how to tackle the softmax in self-attention mechanism, the core ingredient of Transformer. In particular, we diagnose the scaling scheme, carefully tackle the input/output of softmax, and prove that quadratic overparameterization is sufficient for global convergence of our shallow Transformers under commonly-used He/LeCun initialization in practice. Besides, neural tangent kernel (NTK) based analysis is also given, which facilitates a comprehensive comparison. Our theory demonstrates the separation on the importance of different scaling schemes and initialization. We believe our results can pave the way for a better understanding of modern Transformers, particularly on training dynamics.
SoundCam: A Dataset for Finding Humans Using Room Acoustics
Authors: Samuel Clarke, Jui-Hsien Wang, Ruohan Gao, Jiajun Wu Mason Wang
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Datasets and Benchmarks Track), 2023

Abstract: A room’s acoustic properties are a product of the room’s geometry, the objects within the room, and their specific positions. A room’s acoustic properties can be characterized by its impulse response (RIR) between a source and listener location, or roughly inferred from recordings of natural signals present in the room. Variations in the positions of objects in a room can effect measurable changes in the room’s acoustic properties, as characterized by the RIR. Existing datasets of RIRs either do not systematically vary positions of objects in an environment, or they consist of only simulated RIRs. We present SoundCam, the largest dataset of unique RIRs from in-the-wild rooms publicly released to date. It includes 5,000 10-channel real-world measurements of room impulse responses and 2,000 10-channel recordings of music in three different rooms, including a controlled acoustic lab, an in-the-wild living room, and a conference room, with different humans in positions throughout each room. We show that these measurements can be used for interesting tasks, such as detecting and identifying humans, and tracking their positions.
Accelerated On-Device Forward Neural Network Training with Module-Wise Descending Asynchronism
Authors: Hualin Zhang, Zhouyuan Huo, Bin Gu Xiaohan Zhao
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: On-device learning faces memory constraints when optimizing or fine-tuning on edge devices with limited resources. Current techniques for training deep models on edge devices rely heavily on backpropagation. However, its high memory usage calls for a reassessment of its dominance.In this paper, we propose forward gradient descent (FGD) as a potential solution to overcome the memory capacity limitation in on-device learning. However, FGD's dependencies across layers hinder parallel computation and can lead to inefficient resource utilization.To mitigate this limitation, we propose AsyncFGD, an asynchronous framework that decouples dependencies, utilizes module-wise stale parameters, and maximizes parallel computation. We demonstrate its convergence to critical points through rigorous theoretical analysis.Empirical evaluations conducted on NVIDIA's AGX Orin, a popular embedded device,  show that AsyncFGD reduces memory consumption and enhances hardware efficiency, offering a novel approach to on-device learning.
Optimal Parameter and Neuron Pruning for Out-of-Distribution Detection
Authors: Zhihang Fu, Kai Liu, Ze Chen, Mingyuan Tao, Jieping Ye Chao Chen
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: For a machine learning model deployed in real world scenarios, the ability of detecting out-of-distribution (OOD) samples is indispensable and challenging. Most existing OOD detection methods focused on exploring advanced training skills or training-free tricks to prevent the model from yielding overconfident confidence score for unknown samples. The training-based methods require expensive training cost and rely on OOD samples which are not always available, while most training-free methods can not efficiently utilize the prior information from the training data. In this work, we propose an \textbf{O}ptimal \textbf{P}arameter and \textbf{N}euron \textbf{P}runing (\textbf{OPNP}) approach, which aims to identify and remove those parameters and neurons that lead to over-fitting. The main method is divided into two steps. In the first step, we evaluate the sensitivity of the model parameters and neurons by averaging gradients over all training samples. In the second step, the parameters and neurons with exceptionally large or close to zero sensitivities are removed for prediction. Our proposal is training-free, compatible with other post-hoc methods, and exploring the information from all training data. Extensive experiments are performed on multiple OOD detection tasks and model architectures, showing that our proposed OPNP consistently outperforms the existing methods by a large margin.
Unbalanced Low-rank Optimal Transport Solvers
Authors: Michal Klein, Giovanni Palla, Marco Cuturi Meyer Scetbon
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: The relevance of optimal transport methods to machine learning has long been hindered by two salient limitations.First, the $O(n^3)$ computational cost of standard sample-based solvers (when used on batches of $n$ samples) is prohibitive.Second, the mass conservation constraint makes OT solvers too rigid in practice: because they must match \textit{all} points from both measures, their output can be heavily influenced by outliers.A flurry of recent works in OT has addressed these computational and modelling limitations, but has resulted in two separate strains of methods:While the computational outlook was much improved by entropic regularization, more recent $O(n)$ linear-time \textit{low-rank} solvers hold the promise to scale up OT further.On the other hand, modelling rigidities have been eased owing to unbalanced variants of OT, that rely on penalization terms to promote, rather than impose, mass conservation.The goal of this paper is to merge these two strains, to achieve the promise of \textit{both} versatile/scalable unbalanced/low-rank OT solvers. We propose custom algorithms to implement these extensions for the linear OT problem and its Fused-Gromov-Wasserstein generalization, and demonstrate their practical relevance to challenging spatial transcriptomics matching problems.
Geodesic Multi-Modal Mixup for Robust Fine-Tuning
Authors: Junhyuk So, Hoyoon Byun, YongTaek Lim, Minchul Shin, Jong-June Jeon, Kyungwoo Song Changdae Oh
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: Pre-trained multi-modal models, such as CLIP, provide transferable embeddings and show promising results in diverse applications. However, the analysis of learned multi-modal embeddings is relatively unexplored, and the embedding transferability can be improved. In this work, we observe that CLIP holds separated embedding subspaces for two different modalities, and then we investigate it through the lens of \textit{uniformity-alignment} to measure the quality of learned representation. Both theoretically and empirically, we show that CLIP retains poor uniformity and alignment even after fine-tuning. Such a lack of alignment and uniformity might restrict the transferability and robustness of embeddings. To this end, we devise a new fine-tuning method for robust representation equipping better alignment and uniformity. First, we propose a \textit{Geodesic Multi-Modal Mixup} that mixes the embeddings of image and text to generate hard negative samples on the hypersphere. Then, we fine-tune the model on hard negatives as well as original negatives and positives with contrastive loss. Based on the theoretical analysis about hardness guarantee and limiting behavior, we justify the use of our method. Extensive experiments on retrieval, calibration, few- or zero-shot classification (under distribution shift), embedding arithmetic, and image captioning further show that our method provides transferable representations, enabling robust model adaptation on diverse tasks.
Scissorhands: Exploiting the Persistence of Importance Hypothesis for LLM KV Cache Compression at Test Time
Authors: Aditya Desai, Fangshuo Liao, Weitao Wang, Victor Xie, Zhaozhuo Xu, Anastasios Kyrillidis, Anshumali Shrivastava Zichang Liu
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: Large language models(LLMs) have sparked a new wave of exciting AI applications. Hosting these models at scale requires significant memory resources. One crucial memory bottleneck for the deployment stems from the context window. It is commonly recognized that model weights are memory hungry; however, the size of key-value embedding stored during the generation process (KV cache) can easily surpass the model size. The enormous size of the KV cache puts constraints on the inference batch size, which is crucial for high throughput inference workload. Inspired by an interesting observation of the attention scores, we hypothesize the persistence of importance: only pivotal tokens, which had a substantial influence at one step, will significantly influence future generations. Based on our empirical verification and theoretical analysis around this hypothesis, we propose scissorhands, a system that maintains the memory usage of the KV cache at a fixed budget without finetuning the model. In essence, Scissorhands manages the KV cache by storing the pivotal tokens with a higher probability. We validate that scissorhands reduces the inference memory usage of the KV cache by up to 5$\times$ without compromising model quality. We further demonstrate that scissorhands can be combined with 4-bit quantization, traditionally used to compress model weights, to achieve up to 20$\times$ compression.
Asymmetric Certified Robustness via Feature-Convex Neural Networks
Authors: Brendon Anderson, Julien Piet, Somayeh Sojoudi Samuel Pfrommer
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: Real-world adversarial attacks on machine learning models often feature an asymmetric structure wherein adversaries only attempt to induce false negatives (e.g., classify a spam email as not spam). We formalize the asymmetric robustness certification problem and correspondingly present the feature-convex neural network architecture, which composes an input-convex neural network (ICNN) with a Lipschitz continuous feature map in order to achieve asymmetric adversarial robustness. We consider the aforementioned binary setting with one "sensitive" class, and for this class we prove deterministic, closed-form, and easily-computable certified robust radii for arbitrary $\ell_p$-norms. We theoretically justify the use of these models by characterizing their decision region geometry, extending the universal approximation theorem for ICNN regression to the classification setting, and proving a lower bound on the probability that such models perfectly fit even unstructured uniformly distributed data in sufficiently high dimensions. Experiments on Malimg malware classification and subsets of the MNIST, Fashion-MNIST, and CIFAR-10 datasets show that feature-convex classifiers attain substantial certified $\ell_1$, $\ell_2$, and $\ell_{\infty}$-radii while being far more computationally efficient than competitive baselines.
A Unified Fast Gradient Clipping Framework for DP-SGD
Authors: Andres Munoz Medina Weiwei Kong
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: A well-known numerical bottleneck in the differentially-private stochastic gradient descent (DP-SGD) algorithm is the computation of the gradient norm for each example in a large input batch. When the loss function in DP-SGD is consists of an intermediate linear operation, existing methods in the literature have proposed decompositions of gradients that are amenable to fast norm computations. In this paper, we present a framework that generalizes the above approach to arbitrary (possibly nonlinear) intermediate operations. Moreover, we show that for certain operations, such as fully-connected and embedding layer computations, further improvements to the runtime and storage costs of existing decompositions can be deduced using certain components of our framework. Finally, preliminary numerical experiments are given to demonstrate the substantial effects of the aforementioned improvements.
Offline Multi-Agent Reinforcement Learning with Implicit Global-to-Local Value Regularization
Authors: Haoran Xu, Yinan Zheng, Xianyuan Zhan Xiangsen Wang
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: Offline reinforcement learning (RL) has received considerable attention in recent years due to its attractive capability of learning policies from offline datasets without environmental interactions. Despite some success in the single-agent setting, offline multi-agent RL (MARL) remains to be a challenge. The large joint state-action space and the coupled multi-agent behaviors pose extra complexities for offline policy optimization. Most existing offline MARL studies simply apply offline data-related regularizations on individual agents, without fully considering the multi-agent system at the global level. In this work, we present OMIGA, a new offline multi-agent RL algorithm with implicit global-to-local value regularization. OMIGA provides a principled framework to convert global-level value regularization into equivalent implicit local value regularizations and simultaneously enables in-sample learning, thus elegantly bridging multi-agent value decomposition and policy learning with offline regularizations. Based on comprehensive experiments on the offline multi-agent MuJoCo and StarCraft II micro-management tasks, we show that OMIGA achieves superior performance over the state-of-the-art offline MARL methods in almost all tasks.
Benchmarking Large Language Models on CMExam - A comprehensive Chinese Medical Exam Dataset
Authors: Peilin Zhou, Yining Hua, Dading Chong, Zhongyu Tian, Andrew Liu, Helin Wang, Chenyu You, Zhenhua Guo, LEI ZHU, Michael Lingzhi Li Junling Liu
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Datasets and Benchmarks Track), 2023

Abstract: Recent advancements in large language models (LLMs) have transformed the field of question answering (QA). However, evaluating LLMs in the medical field is challenging due to the lack of standardized and comprehensive datasets. To address this gap, we introduce CMExam, sourced from the Chinese National Medical Licensing Examination. CMExam consists of 60K+ multiple-choice questions for standardized and objective evaluations, as well as solution explanations for model reasoning evaluation in an open-ended manner. For in-depth analyses of LLMs, we invited medical professionals to label five additional question-wise annotations, including disease groups, clinical departments, medical disciplines, areas of competency, and question difficulty levels. Alongside the dataset, we further conducted thorough experiments with representative LLMs and QA algorithms on CMExam. The results show that GPT-4 had the best accuracy of 61.6% and a weighted F1 score of 0.617. These results highlight a great disparity when compared to human accuracy, which stood at 71.6%. For explanation tasks, while LLMs could generate relevant reasoning and demonstrate improved performance after finetuning, they fall short of a desired standard, indicating ample room for improvement. To the best of our knowledge, CMExam is the first Chinese medical exam dataset to provide comprehensive medical annotations. The experiments and findings of LLM evaluation also provide valuable insights into the challenges and potential solutions in developing Chinese medical QA systems and LLM evaluation pipelines.
A Logic for Expressing Log-Precision Transformers
Authors: Ashish Sabharwal William Merrill
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: One way to interpret the reasoning power of transformer-based language models is to describe the types of logical rules they can resolve over some input text. Recently, Chiang et al. (2023) showed that finite-precision transformer classifiers can be equivalently expressed in a generalization of first-order logic. However, finite-precision transformers are a weak transformer variant because, as we show, a single head can only attend to a constant number of tokens and, in particular, cannot represent uniform attention. Since attending broadly is a core capability for transformers, we ask whether a minimally more expressive model that can attend universally can also be characterized in logic. To this end, we analyze transformers whose forward pass is computed in $\log n$ precision on contexts of length $n$. We prove any log-precision transformer classifier can be equivalently expressed as a first-order logic sentence that, in addition to standard universal and existential quantifiers, may also contain majority-vote quantifiers. This is the tightest known upper bound and first logical characterization of log-precision transformers.
Universal Prompt Tuning for Graph Neural Networks
Authors: Yunchao Zhang, YANG YANG, Chunping Wang, Lei Chen Taoran Fang
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: In recent years, prompt tuning has sparked a research surge in adapting pre-trained models. Unlike the unified pre-training strategy employed in the language field, the graph field exhibits diverse pre-training strategies, posing challenges in designing appropriate prompt-based tuning methods for graph neural networks. While some pioneering work has devised specialized prompting functions for models that employ edge prediction as their pre-training tasks, these methods are limited to specific pre-trained GNN models and lack broader applicability. In this paper, we introduce a universal prompt-based tuning method called Graph Prompt Feature (GPF) for pre-trained GNN models under any pre-training strategy. GPF operates on the input graph's feature space and can theoretically achieve an equivalent effect to any form of prompting function. Consequently, we no longer need to illustrate the prompting function corresponding to each pre-training strategy explicitly. Instead, we employ GPF to obtain the prompted graph for the downstream task in an adaptive manner. We provide rigorous derivations to demonstrate the universality of GPF and make guarantee of its effectiveness. The experimental results under various pre-training strategies indicate that our method performs better than fine-tuning, with an average improvement of about 1.4% in full-shot scenarios and about 3.2% in few-shot scenarios. Moreover, our method significantly outperforms existing specialized prompt-based tuning methods when applied to models utilizing the pre-training strategy they specialize in. These numerous advantages position our method as a compelling alternative to fine-tuning for downstream adaptations.
Stochastic Approximation Approaches to Group Distributionally Robust Optimization
Authors: Peng Zhao, Zhen-Hua Zhuang, Tianbao Yang, Zhi-Hua Zhou Lijun Zhang
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: This paper investigates group distributionally robust optimization (GDRO), with the purpose to learn a model that performs well over $m$ different distributions. First, we formulate GDRO as a stochastic convex-concave saddle-point problem, and demonstrate that stochastic mirror descent (SMD), using $m$ samples in each iteration, achieves an $O(m (\log m)/\epsilon^2)$ sample complexity for finding an $\epsilon$-optimal solution, which matches the $\Omega(m/\epsilon^2)$ lower bound up to a logarithmic factor. Then, we make use of techniques from online learning to reduce the number of samples required in each round from $m$ to $1$, keeping the same sample complexity. Specifically, we cast GDRO as a two-players game where one player simply performs SMD and the other executes an online algorithm for non-oblivious multi-armed bandits. Next, we consider a more practical scenario where the number of samples that can be drawn from each distribution is different, and propose a novel formulation of weighted GDRO, which allows us to derive distribution-dependent convergence rates.  Denote by $n_i$ the sample budget for the $i$-th distribution, and assume $n_1 \geq n_2 \geq \cdots \geq n_m$. In the first approach, we incorporate non-uniform sampling into SMD such that the sample budget is satisfied in expectation, and prove that the excess risk of the $i$-th distribution decreases at an $O(\sqrt{n_1 \log m}/n_i)$ rate. In the second approach, we use mini-batches to meet the budget exactly and also reduce the variance in stochastic gradients, and then leverage stochastic mirror-prox algorithm, which can exploit small variances, to optimize a carefully designed weighted GDRO problem. Under appropriate conditions, it attains an $O((\log m)/\sqrt{n_i})$ convergence rate, which almost matches the optimal $O(\sqrt{1/n_i})$ rate of only learning from the $i$-th distribution with $n_i$ samples.
Learning Efficient Surrogate Dynamic Models with Graph Spline Networks
Authors: Federico Berto, Michael Poli, Stefano Massaroli, Jinkyoo Park Chuanbo Hua
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: While complex simulations of physical systems have been widely used in engineering and scientific computing, lowering their often prohibitive computational requirements has only recently been tackled by deep learning approaches. In this paper, we present GraphSplineNets, a novel deep-learning method to speed up the forecasting of physical systems by reducing the grid size and number of iteration steps of deep surrogate models. Our method uses two differentiable orthogonal spline collocation methods to efficiently predict response at any location in time and space. Additionally, we introduce an adaptive collocation strategy in space to prioritize sampling from the most important regions. GraphSplineNets improve the accuracy-speedup tradeoff in forecasting various dynamical systems with increasing complexity, including the heat equation, damped wave propagation, Navier-Stokes equations, and real-world ocean currents in both regular and irregular domains.
Efficient Adaptation of Large Vision Transformer via Adapter Re-Composing
Authors: Dawei Yan, Zhijun Lin, Peng Wang Wei Dong
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: The advent of high-capacity pre-trained models has revolutionized problem-solving in computer vision, shifting the focus from training task-specific models to adapting pre-trained models. Consequently, effectively adapting large pre-trained models to downstream tasks in an efficient manner has become a prominent research area. Existing solutions primarily concentrate on designing lightweight adapters and their interaction with pre-trained models, with the goal of minimizing the number of parameters requiring updates. In this study, we propose a novel Adapter Re-Composing (ARC) strategy that addresses efficient pre-trained model adaptation from a fresh perspective. Our approach considers the reusability of adaptation parameters and introduces a parameter-sharing scheme. Specifically, we leverage symmetric down-/up-projections to construct bottleneck operations, which are shared across layers. By learning low-dimensional re-scaling coefficients, we can effectively re-compose layer-adaptive adapters. This parameter-sharing strategy in adapter design allows us to further reduce the number of new parameters while maintaining satisfactory performance, thereby offering a promising approach to compress the adaptation cost. We conduct experiments on 24 downstream image classification tasks using various Vision Transformer variants to evaluate our method. The results demonstrate that our approach achieves compelling transfer learning performance with a reduced parameter count. Our code is available at https://github.com/DavidYanAnDe/ARC.
Hardness of Low Rank Approximation of Entrywise Transformed Matrix Products
Authors: Xingyou Song, David Woodruff, Richard Zhang Tamas Sarlos
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: Inspired by fast algorithms in natural language processing, we study low rank approximation in the entrywise transformed setting where we want to find a good rank $k$ approximation to $f(U \cdot V)$, where $U, V^\top \in \mathbb{R}^{n \times r}$ are given, $r = O(\log(n))$, and $f(x)$ is a general scalar function. Previous work in sublinear low rank approximation has shown that if both (1) $U = V^\top$ and (2) $f(x)$ is a PSD kernel function, then there is an $O(nk^{\omega-1})$ time constant relative error approximation algorithm, where $\omega \approx 2.376$ is the exponent of matrix multiplication. We give the first conditional time hardness results for this problem, demonstrating that both conditions (1) and (2) are in fact necessary for getting better than $n^{2-o(1)}$ time for a relative error low rank approximation for a wide class of functions. We give novel reductions from the Strong Exponential Time Hypothesis (SETH) that rely on lower bounding the leverage scores of flat sparse vectors and hold even when the rank of the transformed matrix $f(UV)$ and the target rank are $n^{o(1)}$, and when $U = V^\top$. Furthermore, even when $f(x) = x^p$ is a simple polynomial, we give runtime lower bounds in the case when $U \neq V^\top$ of the form $\Omega(\min(n^{2-o(1)}, \Omega(2^p)))$. Lastly, we demonstrate that our lower bounds are tight by giving an $O(n \cdot \text{poly}(k, 2^p, 1/\epsilon))$ time relative error approximation algorithm and a fast $O(n \cdot \text{poly}(k, p, 1/\epsilon))$ additive error approximation using fast tensor-based sketching. Additionally, since our low rank algorithms rely on matrix-vector product subroutines, our lower bounds extend to show that computing $f(UV)W$, for even a small matrix $W$, requires $\Omega(n^{2-o(1)})$ time.
Efficient Training of Energy-Based Models Using Jarzynski Equality
Authors: Mengjian Hua, Simon Coste, Eric Vanden-Eijnden Davide Carbone
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: Energy-based models (EBMs) are generative models inspired by statistical physics with a wide range of applications in unsupervised learning.  Their performance is well measured by the cross-entropy (CE) of the model distribution relative to the data distribution. Using the CE as the objective for training is however challenging because the computation of its gradient with respect to the model parameters requires sampling the model distribution. Here we show how results for nonequilibrium thermodynamics based on Jarzynski equality together with tools from sequential Monte-Carlo sampling can be used to perform this computation efficiently and avoid the uncontrolled approximations made using the standard contrastive divergence algorithm.  Specifically, we introduce a modification of the unadjusted Langevin algorithm (ULA) in which each walker acquires a  weight that enables the estimation of the gradient of the cross-entropy at any step during GD, thereby bypassing sampling biases induced by slow mixing of ULA. We illustrate these results with numerical experiments on Gaussian mixture distributions as well as the MNIST and CIFAR-10 datasets. We show that the proposed approach outperforms  methods based on the contrastive divergence algorithm in all the considered situations.
High Precision Causal Model Evaluation with Conditional Randomization
Authors: Cheng Zhang Chao Ma
Published in: Advances in Neural Information Processing Systems 36  (NeurIPS 2023) (Main Conference Track), 2023

Abstract: The gold standard for causal model evaluation involves comparing model predictions with true effects estimated from randomized controlled trials (RCT). However, RCTs are not always feasible or ethical to perform. In contrast, conditionally randomized experiments based on inverse probability weighting (IPW) offer a more realistic approach but may suffer from high estimation variance. To tackle this challenge and enhance causal model evaluation in real-world conditional randomization settings, we introduce a novel low-variance estimator for causal error, dubbed as the pairs estimator. By applying the same IPW estimator to both the model and true experimental effects, our estimator effectively cancels out the variance due to IPW and achieves a smaller asymptotic variance. Empirical studies demonstrate the improved of our estimator, highlighting its potential on achieving near-RCT performance. Our method offers a simple yet powerful solution to evaluate causal inference models in conditional randomization settings without complicated modification of the IPW estimator itself, paving the way for more robust and reliable model assessments.