NeurIPS 2025 Papers

Understanding the remarkable efficacy of Adam when training transformer-based language models has become a central research topic within the optimization community. To gain deeper insights, several simplifications of Adam have been proposed, such as the signed gradient and signed momentum methods. In this work, we conduct an extensive empirical study — training over 1,500 language models across different data configurations and scales — comparing Adam to several known simplified variants. We find that signed momentum methods are faster than SGD, but consistently underperform relative to Adam, even after careful tuning of momentum, clipping setting and learning rates. However, our analysis reveals a compelling option that preserves near-optimal performance while allowing for new insightful reformulations: constraining the Adam momentum parameters to be equal, $\beta_1=\beta_2$. Beyond robust performance, this choice affords new theoretical insights, highlights the "secret sauce" on top of signed momentum, and grants a precise statistical interpretation: we show that Adam in this setting implements a natural online algorithm for estimating the mean and variance of gradients—one that arises from a mean-field Gaussian variational inference perspective.

As both model and dataset sizes continue to scale rapidly, conventional pretraining strategies with fixed compute budgets—such as cosine learning rate schedules—are increasingly inadequate for large-scale training. Recent alternatives, including warmup-stable-decay (WSD) schedules and weight averaging, offer greater flexibility. However, WSD relies on explicit decay phases to track progress, while weight averaging addresses this limitation at the cost of additional memory. In search of a more principled and scalable alternative, we revisit the Schedule-Free (SF) method [Defazio et al., 2024], which has shown strong empirical performance across diverse settings. We show that SF-AdamW effectively navigates the "river" structure of the loss landscape without decay phases or auxiliary averaging, making it particularly suitable for continuously scaling training workloads. To understand this behavior, we conduct a theoretical and empirical analysis of SF dynamics, revealing that it implicitly performs weight averaging without memory overhead. Guided by this analysis, we propose a refined variant of SF that improves robustness to momentum and performs better under large batch sizes, addressing key limitations of the original method. Together, these results establish SF as a practical, scalable, and theoretically grounded approach for language model training.

Diffusion models have demonstrated exceptional capabilities in generating high-fidelity images but typically suffer from inefficient sampling. Many solver designs and noise scheduling strategies have been proposed to dramatically improve sampling speeds. In this paper, we introduce a new sampling method that is up to 186\% faster than the current state of the art solver for comparative FID on ImageNet512. This new sampling method is training-free and uses an ordinary differential equation (ODE) solver. The key to our method resides in using higher-dimensional initial noise, allowing to produce more detailed samples with less function evaluations from existing pretrained diffusion models. In addition, by design our solver allows to control the level of detail through a simple hyper-parameter at no extra computational cost. We present how our approach leverages momentum dynamics by establishing a fundamental equivalence between momentum diffusion models and conventional diffusion models with respect to their training paradigms. Moreover, we observe the use of higher-dimensional noise naturally exhibits characteristics similar to stochastic differential equations (SDEs). Finally, we demonstrate strong performances on a set of representative pretrained diffusion models, including EDM, EDM2, and Stable-Diffusion 3, which cover models in both pixel and latent spaces, as well as class and text conditional settings. The code is available at https://github.com/apple/ml-tada.

Monocular depth estimation has advanced significantly with foundation models like Depth Anything, leveraging large-scale transformer architectures for the superior generalization. However, the deployment on resource-constrained devices remains challenging due to the high computation and memory requirement. Existing quantization methods, such as post-training quantization and quantization-aware training, often face trade-offs between efficiency and accuracy, or require extensive labeled data for retraining. To address these limitations, we propose Quantization with Self-Compensating Auxiliary for Monocular Depth Estimation (QSCA), a novel framework for 4-bit post-training quantization of Monocular depth estimation models. Our method integrates a lightweight Self-Compensating Auxiliary (SCA) module into both transformer encoder and decoder blocks, enabling the quantized model to recover from performance degradation without requiring ground truth. This design enables fast adaptation while preserving structural and spatial consistency in predicted depth maps. To our knowledge, this is the first framework to successfully apply 4-bit quantization across all layers of large-scale monocular depth estimation models. Experimental results demonstrate that QSCA significantly improves quantized depth estimation performance. On the NYUv2 dataset, it achieves an 11\% improvement in $\delta_1$ accuracy over existing post-training quantization methods.

Despite rapid progress on AI benchmarks, the real-world meaning of benchmark performance remains unclear. To quantify the capabilities of AI systems in terms of human capabilities, we propose a new metric: 50%-task-completion time horizon. This is the time humans typically take to complete tasks that AI models can complete with 50% success rate. We first timed humans with relevant domain expertise on a combination of RE-Bench, HCAST, and 66 novel shorter tasks. On these tasks, current frontier AI models such as o3 have a 50% time horizon of around 110 minutes. Furthermore, frontier AI time horizon has been doubling approximately every seven months since 2019, though the trend may have accelerated since 2024. The increase in AI models’ time horizons seems to be primarily driven by greater reliability and ability to adapt to mistakes, combined with better logical reasoning and tool use capabilities. We discuss the limitations of our results—including their degree of external validity—and the implications of increased autonomy for dangerous capabilities. If these results generalize to real-world software tasks, extrapolation of this trend predicts that within 5 years, AI systems will be capable of automating many software tasks that currently take humans a month.

We study the problem of entropy calibration, which asks whether a language model's entropy over generations matches its log loss on human text. Past work found that models are miscalibrated, with entropy per step increasing (and text quality decreasing) as generations grow longer. This error accumulation is a fundamental problem in autoregressive models, and the standard solution is to truncate the distribution, which improves text quality at the cost of diversity. In this paper, we ask: is miscalibration likely to improve with scale, and is it theoretically possible to calibrate without tradeoffs? To build intuition, we first study a simplified theoretical setting to characterize the scaling behavior of miscalibration with respect to dataset size. We find that the scaling behavior depends on the power law exponent of the data distribution --- in particular, for a power law exponent close to 1, the scaling exponent is close to 0, meaning that miscalibration improves very slowly with scale. Next, we measure miscalibration empirically in language models ranging from 0.5B to 70B parameters. We find that the observed scaling behavior is similar to what is predicted by the simplified setting: our fitted scaling exponents for text are close to 0, meaning that larger models accumulate error at a similar rate as smaller ones. This scaling (or, lack thereof) provides one explanation for why we sample from larger models with similar amounts of truncation as smaller models, even though the larger models are of higher quality. However, truncation is not a satisfying solution because it comes at the cost of increased log loss. In theory, is it even possible to reduce entropy while preserving log loss? We prove that it is possible, if we assume access to a black box which can fit models to predict the future entropy of text.

Recent advances in *inverse problem* solving have increasingly adopted flow *priors* over diffusion models due to their ability to construct straight probability paths from noise to data, thereby enhancing efficiency in both training and inference. However, current flow-based inverse solvers face two primary limitations: (i) they operate directly in pixel space, which demands heavy computational resources for training and restricts scalability to high-resolution images, and (ii) they employ guidance strategies with *prior*-agnostic posterior covariances, which can weaken alignment with the generative trajectory and degrade posterior coverage. In this paper, we propose **LFlow** (**L**atent Refinement via **Flow**s), a *training-free* framework for solving linear inverse problems via pretrained latent flow priors. LFlow leverages the efficiency of flow matching to perform ODE sampling in latent space along an optimal path. This latent formulation further allows us to introduce a theoretically grounded posterior covariance, derived from the optimal vector field, enabling effective flow guidance. Experimental results demonstrate that our proposed method outperforms state-of-the-art latent diffusion solvers in reconstruction quality across most tasks.

Scaling reasoning capabilities beyond traditional domains such as math and coding is hindered by the lack of diverse and high-quality questions. To overcome this limitation, we introduce a scalable approach for generating diverse and challenging reasoning questions, accompanied by reference answers. We present NaturalReasoning, a comprehensive dataset comprising 2.8 million questions that span multiple domains, including STEM fields (e.g., Physics, Computer Science), Economics, Social Sciences, and more. We demonstrate the utility of the questions in NaturalReasoning through knowledge distillation experiments which show that NaturalReasoning can effectively elicit and transfer reasoning capabilities from a strong teacher model. Furthermore, we demonstrate that NaturalReasoning is also effective for unsupervised self-training using external reward models or self-rewarding.

Recent advances in neural decoding have enabled the reconstruction of visual experiences from brain activity, positioning fMRI-to-image reconstruction as a promising bridge between neuroscience and computer vision. However, current methods predominantly rely on subject-specific models or require subject-specific fine-tuning, limiting their scalability and real-world applicability. In this work, we introduce ZEBRA, the first zero-shot brain visual decoding framework that eliminates the need for subject-specific adaptation. Z EBRA is built on the key insight that fMRI representations can be decomposed into subject-related and semantic-related components. By leveraging adversarial training, our method explicitly disentangles these components to isolate subject-invariant, semantic-specific representations. This disentanglement allows ZEBRA to generalize to unseen subjects without any additional fMRI data or retraining. Extensive experiments show that ZEBRA significantly outperforms zero-shot baselines and achieves performance comparable to fully finetuned models on several metrics. Our work represents a scalable and practical step toward universal neural decoding. Code and model weights are available at: https://github.com/xmed-lab/ZEBRA.

The cost and accuracy of simulating complex physical systems using the Finite Element Method (FEM) scales with the resolution of the underlying mesh. Adaptive meshes improve computational efficiency by refining resolution in critical regions, but typically require task-specific heuristics or cumbersome manual design by a human expert. We propose Adaptive Meshing By Expert Reconstruction (AMBER), a supervised learning approach to mesh adaptation. Starting from a coarse mesh, AMBER iteratively predicts the sizing field, i.e., a function mapping from the geometry to the local element size of the target mesh, and uses this prediction to produce a new intermediate mesh using an out-of-the-box mesh generator. This process is enabled through a hierarchical graph neural network, and relies on data augmentation by automatically projecting expert labels onto AMBER-generated data during training. We evaluate AMBER on 2D and 3D datasets, including classical physics problems, mechanical components, and real-world industrial designs with human expert meshes. AMBER generalizes to unseen geometries and consistently outperforms multiple recent baselines, including ones using Graph and Convolutional Neural Networks, and Reinforcement Learning-based approaches.

Cryo-EM is a transformational paradigm in molecular biology where computational methods are used to infer 3D molecular structure at atomic resolution from extremely noisy 2D electron microscope images. At the forefront of research is how to model the structure when the imaged particles exhibit non-rigid conformational flexibility and compositional variation where parts are sometimes missing. We introduce a novel 3D reconstruction framework with a hierarchical Gaussian mixture model, inspired in part by Gaussian Splatting for 4D scene reconstruction. In particular, the structure of the model is grounded in an initial process that infers a part-based segmentation of the particle, providing essential inductive bias in order to handle both conformational and compositional variability. The framework, called \methodName, is shown to reveal biologically meaningful structures on complex experimental datasets, and establishes a new state-of-the-art on CryoBench, a benchmark for cryo-EM heterogeneity methods.

We propose a new benchmark to measure a language model's linguistic reasoning skills without relying on pre-existing language-specific knowledge. The test covers 894 questions grouped in 160 problems across 75 (mostly) extremely low-resource languages, extracted from the International Linguistic Olympiad corpus. To attain high accuracy on this benchmark, models don't need previous knowledge of the tested language, as all the information needed to solve the linguistic puzzle is presented in the context. We find that, while all analyzed models rank below 25% accuracy, there is a significant gap between open and closed models, with the best-performing proprietary model scoring 24.05% and the best-performing open model 8.84%.

Unified Multimodal Generative Models (UMGMs) unify visual understanding and image generation within a single autoregressive framework. However, their ability to continually learn new tasks is severely hindered by catastrophic forgetting, both within a modality (intra-modal) and across modalities (inter-modal). While intra-modal forgetting has been studied in prior continual learning (CL) work, inter-modal forgetting remains largely unexplored. In this paper, we identify and empirically validate this phenomenon in UMGMs and provide a theoretical explanation rooted in gradient conflict between modalities. To address both intra- and inter-modal forgetting, we propose Modality-Decoupled Experts (MoDE), a lightweight and scalable architecture that isolates modality-specific updates to mitigate the gradient conflict and leverages knowledge distillation to prevent catastrophic forgetting and preserve pre-trained capabilities. Unlike previous CL methods that remain modality-coupled and suffer from modality gradient conflict, MoDE explicitly decouples modalities to prevent interference. Experiments across diverse benchmarks demonstrate that MoDE significantly mitigates both inter- and intra-modal forgetting, outperforming prior CL baselines in unified multimodal generation settings.

Dexterous grasping in cluttered environments presents substantial challenges due to the high degrees of freedom of dexterous hands, occlusion, and potential collisions arising from diverse object geometries and complex layouts. To address these challenges, we propose CADGrasp, a two-stage algorithm for general dexterous grasping using single-view point cloud inputs. In the first stage, we predict a scene-decoupled, contact- and collision-aware representation—sparse IBS—as the optimization target. Sparse IBS compactly encodes the geometric and contact relationships between the dexterous hand and the scene, enabling stable and collision-free dexterous grasp pose optimization. To enhance the prediction of this high-dimensional representation, we introduce an occupancy-diffusion model with voxel-level conditional guidance and force closure score filtering. In the second stage, we develop several energy functions and ranking strategies for optimization based on sparse IBS to generate high-quality dexterous grasp poses. Extensive experiments in both simulated and real-world settings validate the effectiveness of our approach, demonstrating its capability to mitigate collisions while maintaining a high grasp success rate across diverse objects and complex scenes.

Reinforcement Learning (RL) can mitigate the causal confusion and distribution shift inherent to imitation learning (IL). However, applying RL to end-to-end autonomous driving (E2E-AD) remains an open problem for its training difficulty, and IL is still the mainstream paradigm in both academia and industry. Recently Model-based Reinforcement Learning (MBRL) have demonstrated promising results in neural planning; however, these methods typically require privileged information as input rather than raw sensor data. We fill this gap by designing Raw2Drive, a dual-stream MBRL approach. Initially, we efficiently train an auxiliary privileged world model paired with a neural planner that uses privileged information as input. Subsequently, we introduce a raw sensor world model trained via our proposed Guidance Mechanism, which ensures consistency between the raw sensor world model and the privileged world model during rollouts. Finally, the raw sensor world model combines the prior knowledge embedded in the heads of the privileged world model to effectively guide the training of the raw sensor policy. Raw2Drive is so far the only RL based end-to-end method on CARLA Leaderboard 2.0, and Bench2Drive and it achieves state-of-the-art performance.

We present $\textbf{FlowRL}$, a novel framework for online reinforcement learning that integrates flow-based policy representation with Wasserstein-2-regularized optimization. We argue that in addition to training signals, enhancing the expressiveness of the policy class is crucial for the performance gains in RL. Flow-based generative models offer such potential, excelling at capturing complex, multimodal action distributions. However, their direct application in online RL is challenging due to a fundamental objective mismatch: standard flow training optimizes for static data imitation, while RL requires value-based policy optimization through a dynamic buffer, leading to difficult optimization landscapes. FlowRL first models policies via a state-dependent velocity field, generating actions through deterministic ODE integration from noise. We derive a constrained policy search objective that jointly maximizes Q through the flow polciy while bounding the Wasserstein-2 distance to a behavior-optimal policy implicitly derived from the replay buffer. This formulation effectively aligns the flow optimization with the RL objective, enabling efficient and value-aware policy learning despite the complexity of the policy class. Empirical evaluations on DMControl and Humanoidbench demonstrate that FlowRL achieves competitive performance in online reinforcement learning benchmarks.

Diffusion models have emerged as state‑of‑the‑art in image synthesis.However, it often suffer from semantic instability and slow iterative denoising. We introduce Latent Alignment Framework (LABridge), a novel Text–Image Latent Alignment Framework via an Ornstein–Uhlenbeck (OU) Process, which explicitly preserves and aligns textual and visual semantics in an aligned latent space. LABridge employs a Text-Image Alignment Encoder (TIAE) to encode text prompts into structured priors that are directly aligned with image latents. Instead of a homogeneous Gaussian, Mean-Conditioned OU process smoothly interpolates between these text‑conditioned priors and image latents, improving stability and reducing the number of denoising steps. Extensive experiments on standard text-to-image benchmarks show that LABridge achieves better text–image alignment metric and competitive FID scores compared to leading diffusion baselines. By unifying text and image representations through principled latent alignment, LABridge paves the way for more efficient, semantically consistent, and high‑fidelity text to image generation.

Large Language Models (LLMs) have recently demonstrated strong capabilities in code-related tasks, but their robustness in code reasoning under perturbations remains underexplored. We introduce CodeCrash, a stress-testing framework with 1,279 questions from CRUXEVAL and LIVECODEBENCH, designed to evaluate reasoning reliability under structural perturbations and misleading natural language (NL) contexts. Through a systematic evaluation of 17 LLMs, we find that models often shortcut reasoning by over-relying on NL cues, leading to an average performance degradation of 23.2% in output prediction tasks. Even with Chain-of-Thought reasoning, models on average still have a 13.8% drop due to distractibility and rationalization, revealing a lack of critical reasoning capability to distinguish the actual code behaviors. While Large Reasoning Models with internal reasoning mechanisms improve robustness by fostering critical thinking, plausible yet incorrect hints can trigger pathological self-reflection, causing 2-3 times token consumption and even catastrophic cognitive dissonance in extreme cases for QwQ-32B. We refer to this phenomenon as Reasoning Collapse. CodeCrash provides a rigorous benchmark for evaluating robustness in code reasoning, guiding future research and development toward more reliable and resilient models.

Large Language Models (LLMs) have demonstrated remarkable capabilities, yet their extensive parameter scales pose significant challenges for practical deployment. Unstructured pruning has emerged as an effective model compression strategy with minimal performance loss, which introduces fine-grained sparsity for weight parameters. While existing methods employ a layer-wise pruning strategy to avoid the complexity of global pruning for billion-scale LLMs, they require appropriate sparsity allocation for the layer-wise pruning objectives and often lead to suboptimal solutions for the overall model. In this paper, we propose Lua-LLM ($\textbf{L}$earning $\textbf{u}$nstructured-sparsity $\textbf{a}$llocation in LLMs), a learning-based global pruning framework that explores the optimal unstructured sparsity allocation. Unlike existing pruning methods, which primarily focus on allocating per-layer sparsity, Lua-LLM achieves flexible allocation for both layer-wise and intra-layer sparsity. Furthermore, Lua-LLM leverages a soft Top-K operator to approximate the importance-based mask selection mechanism, enabling efficient binary mask learning. Experimental results on LLaMA and OPT families demonstrate significant performance improvements over existing methods.