Generative Models

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94 papers in the last four weeks, up 119% on the four weeks before. 0.9% of all new papers.

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Latest papers 813

Apr 18, 2026cs.LG

Applications of deep generative models to DNA reaction kinetics and to cryogenic electron microscopy

This dissertation explores how deep generative models can advance the analysis of challenging biological problems by integrating domain knowledge with deep learning. It focuses on two areas: DNA reaction kinetics and cryogenic electron microscopy (cryo-EM). In the first part, we present ViDa, a biophysics-informed framework leveraging variational autoencoders (VAEs) and geometric scattering transforms to generate biophysically-plausible embeddings of DNA reaction kinetics simulations. These embeddings are reduced to a two-dimensional space to visualize DNA hybridization and toehold-mediated strand displacement reactions. ViDa preserves structure and clusters trajectory ensembles into reaction pathways, making simulation results more interpretable and revealing new mechanistic insights. In the second part, we address key challenges in cryo-EM density map interpretation and protein structure modeling. We provide a comprehensive review and benchmarking of deep learning methods for atomic model building, with improved evaluation metrics and practical guidance. We then present Struc2mapGAN, a generative adversarial network that synthesizes high-fidelity experimental-like cryo-EM density maps from protein structures. Finally, we present CryoSAMU, a structure-aware multimodal U-Net that enhances intermediate-resolution cryo-EM maps by integrating density features with structural embeddings from protein language models via cross-attention. Overall, these contributions demonstrate the potential of deep generative models to interpret DNA reaction mechanisms and advance cryo-EM density map analysis and protein structure modeling.

Chenwei Zhang

THE UNIVERSITY OF BRITISH COLUMBIA (Vancouver)

Cryo-Electron Microscopy Generative Models Behavioral Embeddings Language Modeling

Apr 18, 2026cs.CV

Can We Build Scene Graphs, Not Classify Them? FlowSG: Progressive Image-Conditioned Scene Graph Generation with Flow Matching

Scene Graph Generation (SGG) unifies object localization and visual relationship reasoning by predicting boxes and subject-predicate-object triples. Yet most pipelines treat SGG as a one-shot, deterministic classification problem rather than a genuinely progressive, generative task. We propose FlowSG, which recasts SGG as continuous-time transport on a hybrid discrete-continuous state: starting from a noised graph, the model progressively grows an image-conditioned scene graph through constraint-aware refinements that jointly synthesize nodes (objects) and edges (predicates). Specifically, we first leverage a VQ-VAE to quantize a scene graph (e.g., continuous visual features) into compact, predictable tokens; a graph Transformer then (i) predicts a conditional velocity field to transport continuous geometry (boxes) and (ii) updates discrete posteriors for categorical tokens (object features and predicate labels), coupling semantics and geometry via flow-conditioned message aggregation. Training combines flow-matching losses for geometry with a discrete-flow objective for tokens, yielding few-step inference and plug-and-play compatibility with standard detectors and segmenters. Extensive experiments on VG and PSG under closed- and open-vocabulary protocols show consistent gains in predicate R/mR and graph-level metrics, validating the mixed discrete-continuous generative formulation over one-shot classification baselines, with an average improvement of about 3 points over the state-of-the-art USG-Par.

Xin Hu, Ke Qin, Wen Yin +3

The Laboratory of Intelligent Collaborative Computing of UESTC · Monash University · Guangdong Laboratory of Artificial Intelligence and Digital Economy (SZ)

Spatio-Temporal Scene Graphs Generative Models Rdf

Apr 18, 2026cs.AI

SAVE: A Generalizable Framework for Multi-Condition Single-Cell Generation with Gene Block Attention

Modeling single-cell gene expression across diverse biological and technical conditions is crucial for characterizing cellular states and simulating unseen scenarios. Existing methods often treat genes as independent tokens, overlooking their high-level biological relationships and leading to poor performance. We introduce SAVE, a unified generative framework based on conditional Transformers for multi-condition single-cell modeling. SAVE leverages a coarse-grained representation by grouping semantically related genes into blocks, capturing higher-order dependencies among gene modules. A Flow Matching mechanism and condition-masking strategy further enhance flexible simulation and enable generalization to unseen condition combinations. We evaluate SAVE on a range of benchmarks, including conditional generation, batch effect correction, and perturbation prediction. SAVE consistently outperforms state-of-the-art methods in generation fidelity and extrapolative generalization, especially in low-resource or combinatorially held-out settings. Overall, SAVE offers a scalable and generalizable solution for modeling complex single-cell data, with broad utility in virtual cell synthesis and biological interpretation. Our code is publicly available at https://github.com/fdu-wangfeilab/sc-save

Jiahao Li, Jiayi Dong, Peng Ye +3

College of Computer Science and Artificial Intelligence, Fudan University · Shanghai Key Laboratory of Intelligent Information Processing, Fudan University

Single-Cell Rna Generative Models

Apr 17, 2026cs.CV

C-GenReg: Training-Free 3D Point Cloud Registration by Multi-View-Consistent Geometry-to-Image Generation with Probabilistic Modalities Fusion

We introduce C-GenReg, a training-free framework for 3D point cloud registration that leverages the complementary strengths of world-scale generative priors and registration-oriented Vision Foundation Models (VFMs). Current learning-based 3D point cloud registration methods struggle to generalize across sensing modalities, sampling differences, and environments. Hence, C-GenReg augments the geometric point cloud registration branch by transferring the matching problem into an auxiliary image domain, where VFMs excel, using a World Foundation Model to synthesize multi-view-consistent RGB representations from the input geometry. This generative transfer, preserves spatial coherence across source and target views without any fine-tuning. From these generated views, a VFM pretrained for finding dense correspondences extracts matches. The resulting pixel correspondences are lifted back to 3D via the original depth maps. To further enhance robustness, we introduce a "Match-then-Fuse" probabilistic cold-fusion scheme that combines two independent correspondence posteriors, that of the generated-RGB branch with that of the raw geometric branch. This principled fusion preserves each modality inductive bias and provides calibrated confidence without any additional learning. C-GenReg is zero-shot and plug-and-play: all modules are pretrained and operate without fine-tuning. Extensive experiments on indoor (3DMatch, ScanNet) and outdoor (Waymo) benchmarks demonstrate strong zero-shot performance and superior cross-domain generalization. For the first time, we demonstrate a generative registration framework that operates successfully on real outdoor LiDAR data, where no imagery data is available.

Yuval Haitman, Amit Efraim, Joseph M. Francos

Ben-Gurion University, Beer-Sheva, Israel

Point Cloud Registration Generative Models Multimodal Fusion Training-Free

Apr 17, 2026cs.LG

MidSteer: Optimal Affine Framework for Steering Generative Models

Steering intermediate representations has emerged as a powerful strategy for controlling generative models, particularly in post-deployment alignment and safety settings. However, despite its empirical success, it currently lacks a comprehensive theoretical framework. In this paper, we bridge this gap by formalizing the theory of concept steering. First, we establish a link between steering and affine concept erasure, proving that the standard approach for removing unwanted behaviors is a special case of LEACE (a closed-form method for affine erasure). Next, we formulate a principled theoretical framework for concept switching, LEACE-Switch, and characterize the assumptions under which it provides an optimal affine solution. Building on this analysis, we then introduce MidSteer (Minimal Disturbance concept Steering), a more general affine framework for concept manipulation that relaxes these assumptions and enables directed, minimal-disturbance transformations. We demonstrate that MidSteer performs favorably across a range of tasks, modalities, and architectures, including vision diffusion models and large language models.

Tatiana Gaintseva, Andrew Stepanov, Ziquan Liu +4

Queen Mary University of London, London, UK · Huawei Noah’s Ark, London, UK · QuantumLight Capital, London, UK +2

Steering Generative Models Affine Concept Erasure

Apr 17, 2026cs.LG

Synthetic data in cryptocurrencies using generative models

Data plays a fundamental role in consolidating markets, services, and products in the digital financial ecosystem. However, the use of real data, especially in the financial context, can lead to privacy risks and access restrictions, affecting institutions, research, and modeling processes. Although not all financial datasets present such limitations, this work proposes the use of deep learning techniques for generating synthetic data applied to cryptocurrency price time series. The approach is based on Conditional Generative Adversarial Networks (CGANs), combining an LSTM-type recurrent generator and an MLP discriminator to produce statistically consistent synthetic data. The experiments consider different crypto-assets and demonstrate that the model is capable of reproducing relevant temporal patterns, preserving market trends and dynamics. The generation of synthetic series through GANs is an efficient alternative for simulating financial data, showing potential for applications such as market behavior analysis and anomaly detection, with lower computational cost compared to more complex generative approaches.

André Saimon S. Sousa, Otto Pires, Frank Acasiete +3

Universidade SENAI CIMATEC Salvador, Brazil · CoFi, Universidad Jorge Tadeo Lozano Bogotá, Colombia · Universidade do Estado da Bahia - UNEB Salvador, Brazil

Decentralized Finance Synthetic Data Generative Adversarial Network Generative Models Banking

Apr 17, 2026cs.LG

Sample Complexity Bounds for Stochastic Shortest Path with a Generative Model

We study the sample complexity of learning an

ε

-optimal policy in the Stochastic Shortest Path (SSP) problem. We first derive sample complexity bounds when the learner has access to a generative model. We show that there exists a worst-case SSP instance with

S

states,

A

actions, minimum cost

c_{\min}

, and maximum expected cost of the optimal policy over all states

B_{\star}

, where any algorithm requires at least

Ω(SAB_{\star}^3/(c_{\min}ε^2))

samples to return an

ε

-optimal policy with high probability. Surprisingly, this implies that whenever

c_{\min} = 0

an SSP problem may not be learnable, thus revealing that learning in SSPs is strictly harder than in the finite-horizon and discounted settings. We complement this lower bound with an algorithm that matches it, up to logarithmic factors, in the general case, and an algorithm that matches it up to logarithmic factors even when

c_{\min} = 0

, but only under the condition that the optimal policy has a bounded hitting time to the goal state.

Jean Tarbouriech, Matteo Pirotta, Michal Valko +1

Facebook AI Research Paris & Inria Lille · Facebook AI Research Paris · DeepMind Paris

Optimal Policies Shortest Paths Sample Complexity Generative Models

Apr 17, 2026cs.CV

The Amazing Stability of Flow Matching

The success of deep generative models in generating high-quality and diverse samples is often attributed to particular architectures and large training datasets. In this paper, we investigate the impact of these factors on the quality and diversity of samples generated by \emph{flow-matching} models. Surprisingly, in our experiments on CelebA-HQ dataset, flow matching remains stable even when pruning 50% of the dataset. That is, the quality and diversity of generated samples are preserved. Moreover, pruning impacts the latent representation only slightly, that is, samples generated by models trained on the full and pruned dataset map to visually similar outputs for a given seed. We observe similar stability when changing the architecture or training configuration, such that the latent representation is maintained under these changes as well. Our results quantify just how strong this stability can be in practice, and help explain the reliability of flow-matching models under various perturbations.

Rania Briq, Michael Kamp, Ohad Fried +2

Forschungszentrum Jülich · TU Dortmund · Lamarr Institute +4

Generative Models Lateral String Stability

Apr 17, 2026cs.CV

Making Image Editing Easier via Adaptive Task Reformulation with Agentic Executions

Instruction guided image editing has advanced substantially with recent generative models, yet it still fails to produce reliable results across many seemingly simple cases. We observe that a large portion of these failures stem not from insufficient model capacity, but from poorly formulated editing tasks, such as those involving small targets, implicit spatial relations, or under-specified instructions. In this work, we frame image editing failures as a task formulation problem and propose an adaptive task reformulation framework that improves editing performance without modifying the underlying model. Our key idea is to transform the original image-instruction pair into a sequence of operations that are dynamically determined and executed by a MLLM agent through analysis, routing, reformulation, and feedback-driven refinement. Experiments on multiple benchmarks, including ImgEdit, PICA, and RePlan, across diverse editing backbones such as Qwen Image Edit and Nano Banana, show consistent improvements, with especially large gains on challenging cases. These results suggest that task reformulation is a critical but underexplored factor, and that substantial gains can be achieved by better matching editing tasks to the effective operating regime of existing models.

Bo Zhao, Kairui Guo, Runnan Du +6

Nanjing University China · Beijing Institute of Technology China · College of Artificial Intelligence, China University of Petroleum (Beijing) China +3

Image Editing Multi-Reference Image Generation Generative Models

Apr 17, 2026cs.CV

Beyond Text Prompts: Precise Concept Erasure through Text-Image Collaboration

Text-to-image generative models have achieved impressive fidelity and diversity, but can inadvertently produce unsafe or undesirable content due to implicit biases embedded in large-scale training datasets. Existing concept erasure methods, whether text-only or image-assisted, face trade-offs: textual approaches often fail to fully suppress concepts, while naive image-guided methods risk over-erasing unrelated content. We propose TICoE, a text-image Collaborative Erasing framework that achieves precise and faithful concept removal through a continuous convex concept manifold and hierarchical visual representation learning. TICoE precisely removes target concepts while preserving unrelated semantic and visual content. To objectively assess the quality of erasure, we further introduce a fidelity-oriented evaluation strategy that measures post-erasure usability. Experiments on multiple benchmarks show that TICoE surpasses prior methods in concept removal precision and content fidelity, enabling safer, more controllable text-to-image generation. Our code is available at https://github.com/OpenAscent-L/TICoE.git

Jun Li, Lizhi Xiong, Ziqiang Li +4

Nanjing University of Information Science and Technology · Southeast University · Nanjing University of Science and Technology

Concept Erasure Text Generation Text Analysis and Detection Generative Models

Apr 17, 2026cs.RO

From Seeing to Simulating: Generative High-Fidelity Simulation with Digital Cousins for Generalizable Robot Learning and Evaluation

Learning robust robot policies in real-world environments requires diverse data augmentation, yet scaling real-world data collection is costly due to the need for acquiring physical assets and reconfiguring environments. Therefore, augmenting real-world scenes into simulation has become a practical augmentation for efficient learning and evaluation. We present a generative framework that establishes a generative real-to-sim mapping from real-world panoramas to high-fidelity simulation scenes, and further synthesize diverse cousin scenes via semantic and geometric editing. Combined with high-quality physics engines and realistic assets, the generated scenes support interactive manipulation tasks. Additionally, we incorporate multi-room stitching to construct consistent large-scale environments for long-horizon navigation across complex layouts. Experiments demonstrate a strong sim-to-real correlation validating our platform's fidelity, and show that extensively scaling up data generation leads to significantly better generalization to unseen scene and object variations, demonstrating the effectiveness of Digital Cousins for generalizable robot learning and evaluation.

Jasper Lu, Zhenhao Shen, Yuanfei Wang +8

1Peking University · 2Lightwheel

Sim-To-Real Reinforcement Learning Indoor Scene Generation Scalable Robot Learning Generative Models Twins

Apr 17, 2026cs.CV

Co-generation of Layout and Shape from Text via Autoregressive 3D Diffusion

Recent text-to-scene generation approaches largely reduced the manual efforts required to create 3D scenes. However, their focus is either to generate a scene layout or to generate objects, and few generate both. The generated scene layout is often simple even with LLM's help. Moreover, the generated scene is often inconsistent with the text input that contains non-trivial descriptions of the shape, appearance, and spatial arrangement of the objects. We present a new paradigm of sequential text-to-scene generation and propose a novel generative model for interactive scene creation. At the core is a 3D Autoregressive Diffusion model 3D-ARD+, which unifies the autoregressive generation over a multimodal token sequence and diffusion generation of next-object 3D latents. To generate the next object, the model uses one autoregressive step to generate the coarse-grained 3D latents in the scene space, conditioned on both the current seen text instructions and already synthesized 3D scene. It then uses a second step to generate the 3D latents in the smaller object space, which can be decoded into fine-grained object geometry and appearance. We curate a large dataset of 230K indoor scenes with paired text instructions for training. We evaluate 7B 3D-ARD+, on challenging scenes, and showcase the model can generate and place objects following non-trivial spatial layout and semantics prescribed by the text instructions.

Zhenggang Tang, Yuehao Wang, Yuchen Fan +9

Meta Reality Labs · University of Illinois Urbana-Champaign · University of Texas at Austin

3D Scene Generation 3D Scene Understanding 3D Generation Generative Models Layouts

Apr 16, 2026cs.CV

(1D) Ordered Tokens Enable Efficient Test-Time Search

Tokenization is a key component of autoregressive (AR) generative models, converting raw data into more manageable units for modeling. Commonly, tokens describe local information, such as regions of pixels in images or word pieces in text, and AR generation predicts these tokens in a fixed order. A worthwhile question is whether token structures affect the ability to steer the generation through test-time search, where multiple candidate generations are explored and evaluated by a verifier. Using image generation as our testbed, we hypothesize that recent 1D ordered tokenizers with coarse-to-fine structure can be more amenable to search than classical 2D grid structures. This is rooted in the fact that the intermediate states in coarse-to-fine sequences carry semantic meaning that verifiers can reliably evaluate, enabling effective steering during generation. Through controlled experiments, we find that AR models trained on coarse-to-fine ordered tokens exhibit improved test-time scaling behavior compared to grid-based counterparts. Moreover, we demonstrate that, thanks to the ordered structure, pure test-time search over token sequences (i.e., without training an AR model) can perform training-free text-to-image generation when guided by an image-text verifier. Beyond this, we systematically study how classical search algorithms (best-of-N, beam search, lookahead search) interact with different token structures, as well as the role of different verifiers and AR priors. Our results highlight the impact of token structure on inference-time scalability and provide practical guidance for test-time scaling in AR models.

Zhitong Gao, Parham Rezaei, Ali Cy +7

1Swiss Federal Institute of Technology Lausanne (EPFL) · 2Apple

Autoregressive Image Generation Autoregressive Generation Visual Tokenizers Generative Models Object Tokens Test Time

Apr 16, 2026cs.AI

Towards Faster Language Model Inference Using Mixture-of-Experts Flow Matching

Flow matching retains the generation quality of diffusion models while enabling substantially faster inference, making it a compelling paradigm for generative modeling. However, when applied to language modeling, it exhibits fundamental limitations in representing complex latent distributions with irregular geometries, such as anisotropy and multimodality. To address these challenges, we propose a mixture-of-experts flow matching (MoE-FM) framework, which captures complex global transport geometries in latent space by decomposing them into locally specialized vector fields. Building on MoE-FM, we develop a non-autoregressive (NAR) language modeling approach, named YAN, instantiated with both Transformer and Mamba architectures. Across multiple downstream tasks, YAN achieves generation quality on par with both autoregressive (AR) and diffusion-based NAR language models, while requiring as few as three sampling steps. This yields a

40\times

speedup over AR baselines and up to a

10^3\times

speedup over diffusion language models, demonstrating substantial efficiency advantages for language modeling.

Aihua Li

Duke University

Diffusion Language Models Latent Flow LLM Inference Optimization Generative Models

Apr 16, 2026cs.CV

Beyond Prompts: Unconditional 3D Inversion for Out-of-Distribution Shapes

Text-driven inversion of generative models is a core paradigm for manipulating 2D or 3D content, unlocking numerous applications such as text-based editing, style transfer, or inverse problems. However, it relies on the assumption that generative models remain sensitive to natural language prompts. We demonstrate that for state-of-the-art native text-to-3D generative models, this assumption often collapses. We identify a critical failure mode where generation trajectories are drawn into latent ``sink traps'': regions where the model becomes insensitive to prompt modifications. In these regimes, changes to the input text fail to alter internal representations in a way that alters the output geometry. Crucially, we observe that this is not a limitation of the model's \textit{geometric} expressivity; the same generative models possess the ability to produce a vast diversity of shapes but, as we demonstrate, become insensitive to out-of-distribution \textit{text} guidance. We investigate this behavior by analyzing the sampling trajectories of the generative model, and find that complex geometries can still be represented and produced by leveraging the model's unconditional generative prior. This leads to a more robust framework for text-based 3D shape editing that bypasses latent sinks by decoupling a model's geometric representation power from its linguistic sensitivity. Our approach addresses the limitations of current 3D pipelines and enables high-fidelity semantic manipulation of out-of-distribution 3D shapes. Project webpage: https://daidedou.sorpi.fr/publication/beyondprompts

Victoria Yue Chen, Emery Pierson, Léopold Maillard +1

ETH Zürich · 2 École Polytechnique · Dassault Systèmes

3D Generative Models Generative Models Out-Of-Distribution Inverse Design Prompt Engineering

Apr 16, 2026cs.IR

GenRec: A Preference-Oriented Generative Framework for Large-Scale Recommendation

Generative Retrieval (GR) offers a promising paradigm for recommendation through next-token prediction (NTP). However, scaling it to large-scale industrial systems introduces three challenges: (i) within a single request, the identical model inputs may produce inconsistent outputs due to the pagination request mechanism; (ii) the prohibitive cost of encoding long user behavior sequences with multi-token item representations based on semantic IDs, and (iii) aligning the generative policy with nuanced user preference signals. We present GenRec, a preference-oriented generative framework deployed on the JD App that addresses above challenges within a single decoder-only architecture. For training objective, we propose Page-wise NTP task, which supervises over an entire interaction page rather than each interacted item individually, providing denser gradient signal and resolving the one-to-many ambiguity of point-wise training. On the prefilling side, an asymmetric linear Token Merger compresses multi-token Semantic IDs in the prompt while preserving full-resolution decoding, reducing input length by ~2X with negligible accuracy loss. To further align outputs with user satisfaction, we introduce GRPO-SR, a reinforcement learning method that pairs Group Relative Policy Optimization with NLL regularization for training stability, and employs Hybrid Rewards combining a dense reward model with a relevance gate to mitigate reward hacking. In month-long online A/B tests serving production traffic, GenRec achieves 9.5% improvement in click count and 8.7% in transaction count over the existing pipeline.

Yanyan Zou, Junbo Qi, Lunsong Huang +7

JD.com Beijing, China · Waseda University Tokyo, Japan

Sequential Recommendation Recommendation Next-Token Prediction Generative Models

Apr 16, 2026stat.ML

Expert-Guided Class-Conditional Goodness-of-Fit Scores for Interpretable Classification with Informative Missingness: An Application to Seismic Monitoring

We study a classification problem with three key challenges: pervasive informative missingness, the integration of partial prior expert knowledge into the learning process, and the need for interpretable decision rules. We propose a framework that encodes prior knowledge through an expert-guided class-conditional model for one or more classes, and use this model to construct a small set of interpretable goodness-of-fit features. The features quantify how well the observed data agree with the expert model, isolating the contributions of different aspects of the data, including both observed and missing components. These features are combined with a few transparent auxiliary summaries in a simple discriminative classifier, resulting in a decision rule that is easy to inspect and justify. We develop and apply the framework in the context of seismic monitoring used to assess compliance with the Comprehensive Nuclear-Test-Ban Treaty. We show that the method has strong potential as a transparent screening tool, reducing workload for expert analysts. A simulation designed to isolate the contribution of the proposed framework shows that this interpretable expert-guided method can even outperform strong standard machine-learning classifiers, particularly when training samples are small.

Shahar Cohen, David M. Steinberg, Yael Radzyner +1

Department of Statistics and Operations Research, School of Mathematical Sciences, Tel Aviv University, Tel Aviv, Israel · Israel NDC, Soreq Nuclear Research Center, Yavne, Israel

Missing Data Classifier Full Waveform Inversion Generative Models

Apr 16, 2026eess.IV

Generative Modeling of Complex-Valued Brain MRI Data

Objective. Standard Magnetic Resonance Imaging (MRI) reconstruction pipelines discard phase information captured during acquisition, despite evidence that it encodes tissue properties relevant to tumor diagnosis. Current machine learning approaches inherit this limitation by operating exclusively on reconstructed magnitude images. The aim of this study is to build a generative framework which is capable of jointly modeling magnitude and phase information of complex-valued MRI scans. Approach. The proposed generative framework combines a conditional variational autoencoder, which compresses complex-valued MRI scans into compact latent representations while preserving phase coherence, with a flow-matching-based generative model. Synthetic sample quality is assessed via a real-versus-synthetic classifier and by training downstream classifiers on synthetic data for abnormal tissue detection. Main results. The autoencoder preserves phase coherence above 0.997. Real-versus-synthetic classification yields low AUROC values between 0.50 and 0.66 across all acquisition sequences, indicating generated samples are nearly indistinguishable from real data. In downstream normal-versus-abnormal classification, classifiers trained entirely on synthetic data achieve an AUROC of 0.880, surpassing the real-data baseline of 0.842 on a publicly available dataset (fastMRI). This advantage persists on an independent external test set from a different institution with biopsy-confirmed labels. Significance. The proposed framework demonstrates the feasibility of jointly modeling magnitude and phase information for normal and abnormal complex-valued brain MRI data. Beyond synthetic data generation, it establishes a foundation for the usage of complete brain MRI information in future diagnostic applications and enables systematic investigation of how magnitude and phase jointly encode pathology-specific features.

Marco Schlimbach, Moritz Rempe, Jessica Mnischek +4

Department of Physics, Technical University Dortmund, Otto-Hahn-Straße 4a, 44227 Dortmund, Germany · Institute for AI in Medicine (IKIM), University Hospital Essen, Girardetstraße 2, 45131 Essen, Germany · 3Cancer Research Center Cologne Essen (CCCE), University Medicine Essen, Hufelandstraße 55, 45147 Essen, Germany +4

Magnetic Resonance Imaging Functional Magnetic Resonance Imaging Medical Image Generation Conditional Variational Autoencoder Generative Models Synthetic Data

Apr 16, 2026cs.IR

CPGRec+: A Balance-oriented Framework for Personalized Video Game Recommendations

The rapid expansion of gaming industry requires advanced recommender systems tailored to its dynamic landscape. Existing Graph Neural Network (GNN)-based methods primarily prioritize accuracy over diversity, overlooking their inherent trade-off. To address this, we previously proposed CPGRec, a balance-oriented gaming recommender system. However, CPGRec fails to account for critical disparities in player-game interactions, which carry varying significance in reflecting players' personal preferences and may exacerbate over-smoothness issues inherent in GNN-based models. Moreover, existing approaches underutilize the reasoning capabilities and extensive knowledge of large language models (LLMs) in addressing these limitations. To bridge this gap, we propose two new modules. First, Preference-informed Edge Reweighting (PER) module assigns signed edge weights to qualitatively distinguish significant player interests and disinterests while then quantitatively measuring preference strength to mitigate over-smoothing in graph convolutions. Second, Preference-informed Representation Generation (PRG) module leverages LLMs to generate contextualized descriptions of games and players by reasoning personal preferences from comparing global and personal interests, thereby refining representations of players and games. Experiments on \textcolor{black}{two Steam datasets} demonstrate CPGRec+'s superior accuracy and diversity over state-of-the-art models. The code is accessible at https://github.com/HsipingLi/CPGRec-Plus.

Xiping Li, Aier Yang, Jianghong Ma +4

Harbin Institute of Technology, China · School of Computer Science, Wuhan University, China

Recommendation Graph Neural Networks Generative Models

Apr 16, 2026cs.LG

Generative Augmented Inference

Large language models enable inexpensive AI-generated annotations, but using them reliably for causal inference remains challenging. Naively pooling AI and human data induces bias, while existing methods such as Prediction-Powered Inference (PPI; Angelopoulos et al., 2023a) treat AI outputs as proxies of true labels -- an assumption often violated for generative model outputs in practice. We propose Generative Augmented Inference (GAI), a framework that treats AI outputs as general, potentially high-dimensional informative features for learning human labels rather than as surrogates. GAI flexibly models this relationship using nonparametric methods, enabling consistent estimation and valid inference from combined human and AI data. We establish asymptotic normality and show that, under random labeling, GAI strictly improves asymptotic efficiency over human-data-only estimation whenever AI outputs are informative for true labels. Empirical studies on real-world datasets demonstrate that GAI significantly reduces estimation error and improves confidence interval quality across diverse generative data sources relative to human-only and PPI-based estimation.

Cheng Lu, Mengxin Wang, Dennis J. Zhang +1

Olin Business School, Washington University in St. Louis, USA · Naveen Jindal School of Management, University of Texas at Dallas, USA · W. P. Carey School of Business, Arizona State University, USA

Generative Artificial Intelligence Agentic Inference Causal Inferences Generative Models

Apr 9, 2026cs.CV

Symbiotic-MoE: Unlocking the Synergy between Generation and Understanding

Empowering Large Multimodal Models (LMMs) with image generation often leads to catastrophic forgetting in understanding tasks due to severe gradient conflicts. While existing paradigms like Mixture-of-Transformers (MoT) mitigate this conflict through structural isolation, they fundamentally sever cross-modal synergy and suffer from capacity fragmentation. In this work, we present Symbiotic-MoE, a unified pre-training framework that resolves task interference within a native multimodal Mixture-of-Experts (MoE) Transformers architecture with zero-parameter overhead. We first identify that standard MoE tuning leads to routing collapse, where generative gradients dominate expert utilization. To address this, we introduce Modality-Aware Expert Disentanglement, which partitions experts into task-specific groups while utilizing shared experts as a multimodal semantic bridge. Crucially, this design allows shared experts to absorb fine-grained visual semantics from generative tasks to enrich textual representations. To optimize this, we propose a Progressive Training Strategy featuring differential learning rates and early-stage gradient shielding. This mechanism not only shields pre-trained knowledge from early volatility but eventually transforms generative signals into constructive feedback for understanding. Extensive experiments demonstrate that Symbiotic-MoE achieves rapid generative convergence while unlocking cross-modal synergy, boosting inherent understanding with remarkable gains on MMLU and OCRBench.

Xiangyue Liu, Zijian Zhang, Miles Yang +3

HKUST · Tencent Hunyuan

Cross-Modal Generative Models Synergy

Apr 2, 2026cs.AI

Stabilising Generative Models of Attitude Change

Attitude change - the process by which individuals revise their evaluative stances - has been explained by a set of influential but competing verbal theories. These accounts often function as mechanism sketches: rich in conceptual detail, yet lacking the technical specifications and operational constraints required to run as executable systems. We present a generative actor-based modelling workflow for "rendering" these sketches as runnable actor - environment simulations using the Concordia simulation library. In Concordia, actors operate by predictive pattern completion: an operation on natural language strings that generates a suffix which describes the actor's intended action from a prefix containing memories of their past and observations of the present. We render the theories of cognitive dissonance (Festinger 1957), self-consistency (Aronson 1969), and self-perception (Bem 1972) as distinct decision logics that populate and process the prefix through theory-specific sequences of reasoning steps. We evaluate these implementations across classic psychological experiments. Our implementations generate behavioural patterns consistent with known results from the original empirical literature. However, we find that achieving stable reproduction requires resolving the inherent underdetermination of the verbal accounts and the conflicts between modern linguistic priors and historical experimental assumptions. We document how this manual process of iterative model "stabilisation" surfaces specific operational and socio-ecological dependencies that were largely undocumented in the original verbal accounts. Ultimately, we argue that the manual stabilisation process itself should be regarded as a core part of the methodology functioning to clarify situational and representational commitments needed to generate characteristic effects.

Jayd Matyas, William A. Cunningham, Alexander Sasha Vezhnevets +3

Google DeepMind · University of Toronto · Caltech +1

Agent Behavior Modeling Verbalization Generative Models

Mar 27, 2026cs.CV

GaussianGPT: Towards Autoregressive 3D Gaussian Scene Generation

Most recent advances in 3D generative modeling rely on diffusion or flow-matching formulations. We instead explore a fully autoregressive alternative and introduce GaussianGPT, a transformer-based model that directly generates 3D Gaussians via next-token prediction, thus facilitating full 3D scene generation. We first compress Gaussian primitives into a discrete latent grid using a sparse 3D convolutional autoencoder with vector quantization. The resulting tokens are serialized and modeled using a causal transformer with 3D rotary positional embedding, enabling sequential generation of spatial structure and appearance. Unlike diffusion-based methods that refine scenes holistically, our formulation constructs scenes step-by-step, naturally supporting completion, outpainting, controllable sampling via temperature, and flexible generation horizons. This formulation leverages the compositional inductive biases and scalability of autoregressive modeling while operating on explicit representations compatible with modern neural rendering pipelines, positioning autoregressive transformers as a complementary paradigm for controllable and context-aware 3D generation.

Nicolas von Lützow, Barbara Rössle, Katharina Schmid +1

Technical University of Munich, Germany

3D Scene Generation 3D Gaussian 3D Generation Generative Models Autoregressive Transformers Scene Understanding

Mar 24, 2026cs.LG

Robustness Quantification for Discriminative Models: a New Robustness Metric and its Application to Dynamic Classifier Selection

Among the different possible strategies for evaluating the reliability of individual predictions of classifiers, robustness quantification stands out as a method that evaluates how much uncertainty a classifier could cope with before changing its prediction. However, its applicability is more limited than some of its alternatives, since it requires the use of generative models and restricts the analyses either to specific model architectures or discrete features. In this work, we propose a new robustness metric applicable to any probabilistic discriminative classifier and any type of features. We demonstrate that this new metric is capable of distinguishing between reliable and unreliable predictions, and use this observation to develop new strategies for dynamic classifier selection.

Rodrigo F. L. Lassance, Jasper De Bock

Foundations Lab for imprecise probabilities (FLip), Ghent University, Ghent, Belgium · Statistics Dept., Federal University of São Carlos, São Carlos, São Paulo, Brazil · Institute of Mathematic and Computer Sciences, University of São Paulo, São Carlos, São Paulo, Brazil

Robustness Verification Classifier Discriminative Models Generative Models

Mar 23, 2026cs.LG

Mixture-Greedy for Online Generative Model Selection: Is UCB Necessary in Diversity-Aware Multi-Armed Bandits?

Efficient selection among multiple generative models is increasingly important in modern generative AI, where sampling from suboptimal models is costly. This problem can be viewed as a multi-armed bandit (MAB) task. Under diversity-aware evaluation scores, a non-degenerate mixture of generators can outperform any individual model, distinguishing this MAB setting from classical best-arm identification. Prior approaches incorporate an Upper Confidence Bound (UCB) exploration bonus into the mixture objective. However, across multiple datasets and evaluation metrics, we observe that the UCB term consistently slows convergence and reduces sample efficiency. In contrast, a simple Mixture-Greedy strategy without explicit UCB-type optimism converges faster and achieves even better performance, particularly for widely used metrics such as FID and Vendi where tight confidence bounds are difficult to construct. We provide theoretical insight explaining this behavior: under structural conditions, diversity-aware objectives induce implicit exploration by favoring interior mixtures, leading to sampling of all arms and sublinear regret guarantees for diversity-based objectives. These results suggest that in diversity-aware multi-armed bandits, e.g., for generative model selection, exploration can arise intrinsically from the objective's geometry.

Bahar Dibaei Nia, Farzan Farnia

Department of Computer Science and Engineering, Chinese University of Hong Kong.

Stochastic Multi-Armed Bandits Model Selection Generative Models Generative Artificial Intelligence Mixtures Exploration

Mar 19, 2026cs.CV

Revisiting Autoregressive Models for Generative Image Classification

Class-conditional generative models have emerged as accurate and robust classifiers, with diffusion models demonstrating clear advantages over other visual generative paradigms, including autoregressive (AR) models. In this work, we revisit visual AR-based generative classifiers and identify an important limitation of prior approaches: their reliance on a fixed token order, which imposes a restrictive inductive bias for image understanding. We observe that single-order predictions rely more on partial discriminative cues, while averaging over multiple token orders provides a more comprehensive signal. Based on this insight, we leverage recent any-order AR models to estimate order-marginalized predictions, unlocking the high classification potential of AR models. Our approach consistently outperforms diffusion-based classifiers across diverse image classification benchmarks, while being up to 25x more efficient. Compared to state-of-the-art self-supervised discriminative models, our method delivers competitive classification performance - a notable achievement for generative classifiers.

Ilia Sudakov, Artem Babenko, Dmitry Baranchuk

1HSE University · 2Yandex Research

Autoregressive Image Generation Multi-Reference Image Generation Generative Models Autoregressive Model Diffusion Models

Mar 19, 2026cs.CV

VesselTok: Tokenizing Vessel-like 3D Biomedical Graph Representations for Reconstruction and Generation

Spatial graphs provide a lightweight and elegant representation of curvilinear anatomical structures such as blood vessels, lung airways, and neuronal networks. Accurately modeling these graphs is crucial in clinical and (bio-)medical research. However, the high spatial resolution of large networks drastically increases their complexity, resulting in significant computational challenges. In this work, we aim to tackle these challenges by proposing VesselTok, a framework that approaches spatially dense graphs from a parametric shape perspective to learn latent representations (tokens). VesselTok leverages centerline points with a pseudo radius to effectively encode tubular geometry. Specifically, we learn a novel latent representation conditioned on centerline points to encode neural implicit representations of vessel-like, tubular structures. We demonstrate VesselTok's performance across diverse anatomies, including lung airways, lung vessels, and brain vessels, highlighting its ability to robustly encode complex topologies. To prove the effectiveness of VesselTok's learnt latent representations, we show that they (i) generalize to unseen anatomies, (ii) support generative modeling of plausible anatomical graphs, and (iii) transfer effectively to downstream inverse problems, such as link prediction.

Chinmay Prabhakar, Bastian Wittmann, Tamaz Amiranashvili +6

University of Zurich, Switzerland · ETH AI Center, Zurich, Switzerland · Technical University of Munich, Germany +1

Graph Representation Learning Vessels Neural Representations Generative Models

Mar 15, 2026cs.LG

Trust-Region Noise Search for Black-Box Alignment of Diffusion and Flow Models

Optimizing the noise samples of diffusion and flow models is an increasingly popular approach to align these models to target rewards at inference time. However, we observe that these approaches are usually restricted to differentiable or cheap reward models, the formulation of the underlying pretrained generative model, or are memory/compute inefficient. We instead propose a simple trust-region based search algorithm (TRS) which treats the pre-trained generative and reward models as a black-box and only optimizes the source noise. Our approach achieves a good balance between global exploration and local exploitation, and is versatile and easily adaptable to various generative settings and reward models with minimal hyperparameter tuning. We evaluate TRS across text-to-image, molecule and protein design tasks, and obtain significantly improved output samples over the base generative models and other inference-time alignment approaches which optimize the source noise sample, or even the entire reverse-time sampling noise trajectories in the case of diffusion models. Our source code is publicly available.

Niklas Schweiger, Daniel Cremers, Karnik Ram

Technical University of Munich, Germany · Munich Center for Machine Learning, Germany

Diffusion Alignment Generative Flow Networks Generative Models Flow Models Trust Region

Mar 15, 2026cs.LG

On the (Generative) Linear Sketching Problem

Sketch techniques have been extensively studied in recent years and are especially well-suited to data streaming scenarios, where the sketch summary is updated quickly and compactly. However, it is challenging to recover the current state from these summaries in a way that is accurate, fast, and real. In this paper, we seek a solution that reconciles this tension, aiming for near-perfect recovery with lightweight computational procedures. Focusing on linear sketching problems of the form

\boldsymbolΦf \rightarrow f

, our study proceeds in three stages. First, we dissect existing techniques and show the root cause of the sketching dilemma: an orthogonal information loss. Second, we examine how generative priors can be leveraged to bridge the information gap. Third, we propose FLORE, a novel generative sketching framework that embraces these analyses to achieve the best of all worlds. More importantly, FLORE can be trained without access to ground-truth data. Comprehensive evaluations demonstrate FLORE's ability to provide high-quality recovery, and support summary with low computing overhead, outperforming previous methods by up to 1000 times in error reduction and 100 times in processing speed compared to learning-based solutions.

Xinyu Yuan, Yan Qiao, Zonghui Wang +1

College of Computer Science and Technology, Zhejiang University, Hangzhou, China · School of Computer Science and Information Engineering, Hefei University of Technology, Hefei, China

Generative Models Ground Truth Clover

Mar 14, 2026cs.CV

SK-Adapter: Skeleton-Based Structural Control for Native 3D Generation

Native 3D generative models have achieved remarkable fidelity and speed, yet they suffer from a critical limitation: inability to prescribe precise structural articulations, where precise structural control within the native 3D space remains underexplored. This paper proposes SK-Adapter, a simple yet efficient and effective framework that unlocks precise skeletal manipulation for native 3D generation. Moving beyond text or image prompts, which can be ambiguous for precise structure, we treat the 3D skeleton as a first-class control signal. SK-Adapter is a lightweight structural adapter network that encodes joint coordinates and topology into learnable tokens, which are injected into the frozen 3D generation backbone via cross-attention. This design allows the model to not only effectively ``attend'' to specific 3D structural constraints but also preserve its original generative priors. To bridge the data gap, we contribute the Objaverse-TMS dataset, a large-scale dataset of 24k text-mesh-skeleton pairs. Extensive experiments confirm that our method achieves robust structural control while preserving the geometry and texture quality of the foundation model, significantly outperforming existing baselines. Furthermore, we extend this capability to local 3D editing, enabling region-specific editing of existing assets with skeletal guidance, which is unattainable by previous methods. Project page: https://sk-adapter.github.io/

Anbang Wang, Yuzhuo Ao, Shangzhe Wu +1

The Hong Kong University of Science and Technology · University of Cambridge

High-Fidelity 3D Generation 3D Generation Skeleton Generative Models Frozen Backbone

Mar 9, 2026cs.CV

Evaluating Generative Models via One-Dimensional Code Distributions

Most evaluations of generative models rely on feature-distribution metrics such as FID, which operate on continuous recognition features that are explicitly trained to be invariant to appearance variations, and thus discard cues critical for perceptual quality. We instead evaluate models in the space of discrete visual tokens, where modern 1D image tokenizers compactly encode both semantic and perceptual information and quality manifests as predictable token statistics. We introduce Codebook Histogram Distance (CHD), a training-free distribution metric in token space, and Code Mixture Model Score (CMMS), a no-reference quality metric learned from synthetic degradations of token sequences. To stress-test metrics under broad distribution shifts, we further propose VisForm, a benchmark of 210K images spanning 62 visual forms and 12 generative models with expert annotations. Across AGIQA, HPDv2/3, and VisForm, our token-based metrics achieve state-of-the-art correlation with human judgments. We will release all code and datasets to facilitate future research, with the code publicly available at https://github.com/zexiJia/1d-Distance.

Zexi Jia, Pengcheng Luo, Yijia Zhong +2

WeChat AI, Tencent Inc., China · School of Intelligence Science and Technology, Peking University · College of Computer Science and Artificial Intelligence, Fudan University

Generative Models Long Visual-Token Sequences Single-Token Output Distributions Token-Level Uncertainty Mixture Models

Mar 5, 2026cs.RO

EmboAlign: Aligning Video Generation with Compositional Constraints for Zero-Shot Manipulation

Video generative models (VGMs) pretrained on large-scale internet data can produce temporally coherent rollout videos that capture rich object dynamics, offering a compelling foundation for zero-shot robotic manipulation. However, VGMs often produce physically implausible rollouts, and converting their pixel-space motion into robot actions through geometric retargeting further introduces cumulative errors from imperfect depth estimation and keypoint tracking. To address these challenges, we present EmboAlign, a data-free framework that aligns VGM outputs with compositional constraints generated by vision-language models (VLMs) at inference time. The key insight is that VLMs offer a capability complementary to VGMs: structured spatial reasoning that can identify the physical constraints critical to the success and safety of manipulation execution. Given a language instruction, EmboAlign uses a VLM to automatically extract a set of compositional constraints capturing task-specific requirements, which are then applied at two stages: (1) constraint-guided rollout selection, which scores and filters a batch of VGM rollouts to retain the most physically plausible candidate, and (2) constraint-based trajectory optimization, which uses the selected rollout as initialization and refines the robot trajectory under the same constraint set to correct retargeting errors. We evaluate EmboAlign on six real-robot manipulation tasks requiring precise, constraint-sensitive execution, improving the overall success rate by 43.3 percentage points over the strongest baseline without any task-specific training data.

Gehao Zhang, Zhenyang Ni, Payal Mohapatra +3

Northwestern University · Stanford University

Robotic Manipulation Brain Alignment Autoregressive Rollout Generative Models Spatial Reasoning Structural Constraints

Feb 27, 2026q-bio.BM

Inference-time optimization for experiment-grounded protein ensemble generation

Protein function relies on dynamic conformational ensembles, yet current generative models like AlphaFold3 often fail to produce ensembles that match experimental data. Recent experiment-guided generators attempt to address this by steering the reverse diffusion process. However, these methods are limited by fixed sampling horizons and sensitivity to initialization, often yielding thermodynamically implausible results. We introduce a general inference-time optimization framework to solve these challenges. First, we optimize over latent representations to maximize ensemble log-likelihood, rather than perturbing structures post hoc. This approach eliminates dependence on diffusion length, removes initialization bias, and easily incorporates external constraints. Second, we present novel sampling schemes for drawing Boltzmann-weighted ensembles. By combining structural priors from AlphaFold3 with force-field-based priors, we sample from their product distribution while balancing experimental likelihoods. Our results show that this framework consistently outperforms state-of-the-art guidance, improving diversity, physical energy, and agreement with data in X-ray crystallography and NMR, often fitting the experimental data better than deposited PDB structures. Finally, inference-time optimization experiments maximizing ipTM scores reveal that perturbing AlphaFold3 embeddings can artificially inflate model confidence. This exposes a vulnerability in current design metrics, whose mitigation could offer a pathway to reduce false discovery rates in binder engineering.

Advaith Maddipatla, Anar Rzayev, Marco Pegoraro +5

Institute of Science and Technology, Austria · University of Zurich, Switzerland · Tel Hai – University of Kiryat Shmona in the Galilee, Israel +4

Conformational Ensembles Inference-Time Generative Models Ensemble

Feb 23, 2026cs.LG

Generative Modeling via Kernelized Stochastic Interpolants

We develop a kernel method for generative modeling within the stochastic interpolant framework, replacing neural network training with linear systems. The drift of the generative SDE is

\hat b_t(x) = \nablaφ(x)^\topη_t

, where

η_t \in \mathbb{R}^P

solves a

P\times P

system computable from data, with

P

independent of the data dimension

d

. Since estimates are inexact, the diffusion coefficient

D_t

affects sample quality; the optimal

D_t^*

from Girsanov diverges at

t=0

, but this poses no difficulty and we develop an integrator that handles it seamlessly. The framework accommodates diverse feature maps: scattering transforms, pretrained generative models, etc, enabling generation and model combination without neural network training. We demonstrate the approach on financial time series, turbulence, and image generation.

Florentin Coeurdoux, Etienne Lempereur, Nathanaël Cuvelle-Magar +2

Capital Fund Management, Paris, France · Département d’informatique, ENS, Université PSL, Paris, France · Collège de France, Paris, France +2

Stochastic Interpolants Stochastic Differential Equations Generative Models Kernel Method

Feb 19, 2026eess.IV

MeDUET: Disentangled Unified Pretraining for 3D Medical Image Synthesis and Analysis

Self-supervised learning (SSL) and diffusion models have respectively advanced representation learning and generative modeling for high-dimensional 3D visual data, yet they are often developed as separate paradigms. Their unification remains challenging under multi-source heterogeneity, as anatomical content must be preserved for analysis while acquisition-related style varies across centers and affects synthesis. In this paper, we propose MeDUET, a 3D Medical image Disentangled UnifiEd PreTraining framework in the variational autoencoder latent space. MeDUET formulates unified pretraining as an empirical factor identifiability problem, aiming to learn domain-invariant content factors for anatomy and domain-specific style factors for appearance. To improve factor separation, MeDUET first uses token demixing with a standard adversarial domain regularizer to establish basic content-style specialization, and further introduces Mixed Factor Token Distillation and Swap-invariance Quadruplet Contrast to reduce mixed-region factor leakage and organize factor spaces with factor-wise invariance and discriminability. With these learned factors, MeDUET transfers effectively to both synthesis and analysis, yielding higher fidelity, faster convergence, and better controllability for synthesis, while achieving competitive or superior domain generalization and label efficiency on diverse datasets, tasks, and modalities. Overall, MeDUET shows that multi-source heterogeneity can serve as useful supervision, with disentanglement providing an effective interface for unifying 3D medical image synthesis and analysis. Our code is available at https://github.com/JK-Liu7/MeDUET.

Junkai Liu, Ling Shao, Le Zhang

School of Engineering, College of Engineering and Physical Sciences, University of Birmingham, Birmingham, England, United Kingdom · UCAS-Terminus AI Laboratory, University of Chinese Academy of Sciences, Beijing 100049, China

Medical Image Generation 3D Medical Image Segmentation Generative Models Synthesis Pretraining Adversarial Training+1

Feb 19, 2026cond-mat.mtrl-sci

NextCrystal: a Symmetry-Driven Generative Framework for Crystal Structure Prediction

Crystal structure prediction (CSP), which aims to predict the 3D atomic arrangement of a crystal from its composition, is central to materials discovery and mechanistic understanding. Crystal symmetry plays a crucial role in CSP, but given the composition in a unit cell, existing methods either struggle with the NP-hard combinatorial challenge of enforcing symmetry rigorously or rely on retrieving known templates, inherently limiting both physical fidelity and the discovery of genuinely new materials. To address this challenge, we introduce NextCrystal, a symmetry-driven generative framework that employs large language models to encode chemical semantics and directly generate fine-grained Wyckoff site patterns from atomic stoichiometry, eliminating reliance on database lookups. To overcome the combinatorial complexity of site assignments, we incorporate domain knowledge via an efficient, linear-complexity heuristic beam search, rigorously enforcing algebraic consistency between site multiplicities and atomic stoichiometry. By integrating this symmetry-consistent template into a diffusion backbone, the framework constrains the stochastic generative trajectory to a physically plausible geometric manifold. NextCrystal achieves state-of-the-art performance on stability, uniqueness, and novelty (SUN) benchmarks, as well as superior structural matching, establishing a rigorous paradigm for exploring previously unexplored crystallographic space without relying on prior structural templates. As a representative application, first-principles screening of HfO2 candidates generated by NextCrystal identifies a previously unreported dynamically stable Pnma phase, 0.056~eV/atom lower in energy than the conventional high-pressure Pnma phase.

Jinming Mu, Lixin He, Xudong Zhu +1

Laboratory of Quantum Information, University of Science and Technology of China, Hefei 230026, Anhui, China · Institute of Artificial Intelligence, Hefei Comprehensive National Science Center, Hefei 230088, Anhui, China

Crystal Structure Crystal First-Principles Calculation Symmetry Generative Models

Feb 17, 2026cs.CV

Efficient Generative Modeling beyond Memoryless Diffusion via Adjoint Schrödinger Bridge Matching

Diffusion models often yield highly curved trajectories and noisy score targets due to an uninformative, memoryless forward process that induces independent data-noise coupling. We propose Adjoint Schrödinger Bridge Matching (ASBM), a generative modeling framework that recovers optimal trajectories in high dimensions via two stages. First, we view the Schrödinger Bridge (SB) forward dynamic as a coupling construction problem and learn it through a data-to-energy sampling perspective that transports data to an energy-defined prior. Then, we learn the backward generative dynamic with a simple matching loss supervised by the induced optimal coupling. By operating in a non-memoryless regime, ASBM produces significantly straighter and more efficient sampling paths. Compared to prior works, ASBM scales to high-dimensional data with notably improved stability and efficiency. Extensive experiments on image generation show that ASBM improves fidelity with fewer sampling steps. We further showcase the effectiveness of our optimal trajectory via distillation to a one-step generator.

Jeongwoo Shin, Jinhwan Sul, Joonseok Lee +2

Seoul National University, Seoul, Korea · Georgia Institute of Technology, Atlanta, GA, USA · Sungkyunkwan University, Seoul, Korea

Schrödinger Bridges Diffusion Models Generative Models

Feb 10, 2026cs.LG

Learning on the Manifold: Unlocking Standard Diffusion Transformers with Representation Encoders

Leveraging representation encoders for generative modeling offers a path for efficient, high-fidelity synthesis. However, standard diffusion transformers fail to converge on these representations directly. While recent work attributes this to a capacity bottleneck proposing computationally expensive width scaling of diffusion transformers we demonstrate that the failure is fundamentally geometric. We identify Geometric Interference as the root cause: standard Euclidean flow matching forces probability paths through the low-density interior of the hyperspherical feature space of representation encoders, rather than following the manifold surface. To resolve this, we propose Riemannian Flow Matching with Jacobi Regularization (RJF). By constraining the generative process to the manifold geodesics and correcting for curvature-induced error propagation, RJF enables standard Diffusion Transformer architectures to converge without width scaling. Our method RJF enables the standard DiT-B architecture (131M parameters) to converge effectively, achieving an FID of 3.37 where prior methods fail to converge. Code: https://github.com/amandpkr/RJF

Amandeep Kumar, Vishal M. Patel

Johns Hopkins University

Diffusion Transformers Riemannian Flow Matching Generative Models Manifolds Curvature-Aware Spectral Framework

Feb 10, 2026cs.CV

Allure of Craquelure: A Variational-Generative Approach to Crack Detection in Paintings

Recent advances in imaging technologies, deep learning and numerical performance have enabled non-invasive detailed analysis of artworks, supporting their documentation and conservation. In particular, automated detection of craquelure in digitized paintings is crucial for assessing degradation and guiding restoration, yet remains challenging due to the possibly complex scenery and the visual similarity between cracks and crack-like artistic features such as brush strokes or hair. We propose a hybrid approach that models crack detection as an inverse problem, decomposing an observed image into a crack-free painting and a crack component. A deep generative model is employed as powerful prior for the underlying artwork, while crack structures are captured using a Mumford--Shah-type variational functional together with a crack prior. Joint optimization yields a pixel-level map of crack localizations in the painting.

Laura Paul, Holger Rauhut, Martin Burger +2

Dept. of Mathematics, LMU Munich, Germany · Munich Center for Machine Learning, Germany · Helmholtz Imaging, Deutsches Elektronen-Synchrotron DESY, Germany +2

Art Variational Generative Models Localization

Feb 10, 2026cs.LG

Stabilizing Physics-Informed Consistency Models via Structure-Preserving Training

We propose a physics-informed consistency modeling framework for solving partial differential equations (PDEs) via fast, few-step generative inference. We identify a key stability challenge in physics-constrained consistency training, where PDE residuals can drive the model toward trivial or degenerate solutions, degrading the learned data distribution. To address this, we introduce a structure-preserving two-stage training strategy that decouples distribution learning from physics enforcement by freezing the coefficient decoder during physics-informed fine-tuning. We further propose a two-step residual objective that enforces physical consistency on refined, structurally valid generative trajectories rather than noisy single-step predictions. The resulting framework enables stable, high-fidelity inference for both unconditional generation and forward problems. We demonstrate that forward solutions can be obtained via a projection-based zero-shot inpainting procedure, achieving consistent accuracy of diffusion baselines with orders of magnitude reduction in computational cost.

Che-Chia Chang, Chen-Yang Dai, Te-Sheng Lin +2

Institute of Artificial Intelligence Innovation National Yang Ming Chiao Tung University Hsinchu, Taiwan · Department of Applied Mathematics National Yang Ming Chiao Tung University Hsinchu, Taiwan · Department of Applied Mathematics National Yang Ming Chiao Tung University Hsinchu, Taiwan National Center for Theoretical Sciences National Taiwan University Taipei, Taiwan

Physics-Informed Learning Partial Differential Equations Generative Models Multi-Stage Training

Feb 9, 2026cs.CV

Language-Guided Transformer Tokenizer for Human Motion Generation

In this paper, we focus on motion discrete tokenization, which converts raw motion into compact discrete tokens--a process proven crucial for efficient motion generation. In this paradigm, increasing the number of tokens is a common approach to improving motion reconstruction quality, but more tokens make it more difficult for generative models to learn. To maintain high reconstruction quality while reducing generation complexity, we propose leveraging language to achieve efficient motion tokenization, which we term Language-Guided Tokenization (LG-Tok). LG-Tok aligns natural language with motion at the tokenization stage, yielding compact, high-level semantic representations. This approach not only strengthens both tokenization and detokenization but also simplifies the learning of generative models. Furthermore, existing tokenizers predominantly adopt convolutional architectures, whose local receptive fields struggle to support global language guidance. To this end, we propose a Transformer-based Tokenizer that leverages attention mechanisms to enable effective alignment between language and motion. Additionally, we design a language-drop scheme, in which language conditions are randomly removed during training, enabling the detokenizer to support language-free guidance during generation. On the HumanML3D and Motion-X generation benchmarks, LG-Tok achieves Top-1 scores of 0.542 and 0.582, outperforming state-of-the-art methods (MARDM: 0.500 and 0.528), and with FID scores of 0.057 and 0.088, respectively, versus 0.114 and 0.147. LG-Tok-mini uses only half the tokens while maintaining competitive performance (Top-1: 0.521/0.588, FID: 0.085/0.071), validating the efficiency of our semantic representations. Code and checkpoints are available at https://eanson023.github.io/LG-Tok/

Sheng Yan, Yong Wang, Xin Du +2

1Transsion Ltd. · 2Chongqing University of Technology · 3Afari Intelligence Drive +2

Human Motion Generation Tokenizer Generative Models Motion Transformer Architectures Convolutional Neural Networks

Jan 30, 2026cs.LG

Manifold-Aware Perturbations for Constrained Generative Modeling

Generative models have enjoyed widespread success in a variety of applications. However, they encounter inherent mathematical limitations in modeling distributions where samples are constrained by equalities, as is frequently the setting in scientific domains. In this work, we develop a computationally cheap, mathematically justified, and highly flexible distributional modification for combating known pitfalls in equality-constrained generative models. We propose perturbing the data distribution in a constraint-aware way such that the new distribution has support matching the ambient space dimension while still implicitly incorporating underlying manifold geometry. Through theoretical analyses and empirical evidence on several representative tasks, we illustrate that our approach consistently enables data distribution recovery and stable sampling with both diffusion models and normalizing flows.

Katherine Keegan, Lars Ruthotto

Department of Mathematics, Emory University, Atlanta, Georgia, USA.

Generative Models Manifold Perspective Diffusion Models Distributions

Jan 29, 2026cs.LG

Inverse Problems Conditioned on Observation Ensembles: Applications and Methods

We introduce a new multivariate statistical problem that we refer to as the Ensemble-conditioned Inverse Problem (EIP). The aim of EIP is to invert for an ensemble that is distributed according to the pushforward of a prior under a forward process. In high energy physics (HEP), this is related to a widely known problem called unfolding, which aims to reconstruct the true physics distribution from observations that are distorted by detector effects. The EIP also arises in full waveform inversion (FWI) and inverse imaging with unknown priors. We propose non-iterative inference-time methods that construct posterior samplers based on a new class of conditional generative models, which we call ensemble inverse generative models. For the posterior modeling, these models additionally use the ensemble information contained in the observation set on top of single observations. Unlike existing methods, our proposed methods avoid explicit and iterative use of the forward model at inference time via training across several sets of truth-observation pairs that are consistent with the same forward model, but originate from a wide range of priors. We empirically demonstrate that this training procedure can implicitly encode the likelihood model, enabling direct posterior inference for unseen priors to some degree. We benchmark the proposed method on several synthetic and real datasets in inverse imaging, HEP, and FWI. Our code is available at https://github.com/ZhengyanHuan/EIP.

Zhengyan Huan, Camila Pazos, Martin Klassen +3

Department of Electrical and Computer Engineering, Tufts University, Medford, Massachusetts · The NSF AI Institute for Artificial Intelligence and Fundamental Interactions · Department of Physics and Astronomy, Tufts University, Medford, Massachusetts +1

Inverse Problem Posterior Sampling Full Waveform Inversion Generative Models

Jan 28, 2026cs.LG

Parametric and Generative Forecasts of EPEX Day\char45 Ahead Energy Market Curves

We propose two methodologies for modelling aggregated supply and demand curves in the EPEX SPOT Day\char45 Ahead market, emphasizing generative models as a way to recover distributional variability. The first is a low\char45 dimensional parametric representation that yields deterministic point forecasts; the second is a high\char45 dimensional order\char45 level representation that samples from a conditional distribution of plausible curves. Both model the full curve structure, enabling the analysis of price sensitivity, volume sensitivity, and price impact. The parametric representation uses plateau levels, elastic\char45 region boundaries, and polynomial coefficients, forecast with eXtreme Gradient Boosting. The main contribution is the generative representation, which uses price arrivals and volume\char45 increment marks and is implemented with conditional Denoising Diffusion Probabilistic Models. Using French EPEX data from 2021 to 2024, we evaluate both approaches through curve reconstruction and a price\char45 maker storage optimization problem. The parametric implementation provides a deterministic reference, while the diffusion\char45 based implementation produces distributions of plausible curves and achieves higher realized profits and smaller gaps to an oracle benchmark in the storage application.

Julian Gutierrez, Redouane Silvente

New York University Abu Dhabi, Saadiyat Island, PO Box 129188, Abu Dhabi, United Arab Emirates · CREST, ENSAE, Institut Polytechnique de Paris, 5 Avenue Henry Le Chatelier 91120 Palaiseau, France

Electricity Price Forecasting Electricity Markets Data-Driven Forecasting Curves Conditional Distribution Generative Models+1

Jan 21, 2026cs.LG

Ambient Dataloops: Generative Models for Dataset Refinement

We propose Ambient Dataloops, an iterative framework for refining datasets that makes it easier for diffusion models to learn the underlying data distribution. Modern datasets contain samples of highly varying quality, and training directly on such heterogeneous data often yields suboptimal models. We propose a dataset-model co-evolution process; at each iteration of our method, the dataset becomes progressively higher quality, and the model improves accordingly. To avoid destructive self-consuming loops, at each generation, we treat the synthetically improved samples as noisy, but at a slightly lower noisy level than the previous iteration, and we use Ambient Diffusion techniques for learning under corruption. Empirically, Ambient Dataloops achieve state-of-the-art performance in unconditional and text-conditional image generation and de novo protein design. We further provide a theoretical justification for the proposed framework that captures the benefits of the data looping procedure.

Adrián Rodríguez-Muñoz, William Daspit, Adam Klivans +3

Department of Electrical Engineering and Computer Science, Massachusetts Institute of Technology · Department of Computer Science, University of Texas at Austin

Generative Models Protein Design Co-Evolution

Jan 20, 2026cs.LG

Diff-MN: Diffusion Parameterized MoE-NCDE for Continuous Time Series Generation with Irregular Observations

Time series generation (TSG) is widely used across domains, yet most existing methods assume regular sampling and fixed output resolutions. These assumptions are often violated in practice, where observations are irregular and sparse, while downstream applications require continuous and high-resolution TS. Although Neural Controlled Differential Equation (NCDE) is promising for modeling irregular TS, it is constrained by a single dynamics function, tightly coupled optimization, and limited ability to adapt learned dynamics to newly generated samples from the generative model. We propose Diff-MN, a continuous TSG framework that enhances NCDE with a Mixture-of-Experts (MoE) dynamics function and a decoupled architectural design for dynamics-focused training. To further enable NCDE to generalize to newly generated samples, Diff-MN employs a diffusion model to parameterize the NCDE temporal dynamics parameters (MoE weights), i.e., jointly learn the distribution of TS data and MoE weights. This design allows sample-specific NCDE parameters to be generated for continuous TS generation. Experiments on ten public and synthetic datasets demonstrate that Diff-MN consistently outperforms strong baselines on both irregular-to-regular and irregular-to-continuous TSG tasks. The code is available at the link https://github.com/microsoft/TimeCraft/tree/main/Diff-MN.

Xu Zhang, Junwei Deng, Chang Xu +2

Microsoft Research, Beijing, China · University of Illinois Urbana-Champaign, Illinois, United States · Imperial College London, London, United Kingdom

Time-Series Generation Neural Ordinary Differential Equations Generative Models Temporal Dynamics

Jan 16, 2026physics.ins-det

AllShowers: One model for all calorimeter showers

Accurate and efficient detector simulation is essential for modern collider experiments. To reduce the high computational cost, various fast machine learning surrogate models have been proposed. Traditional surrogate models for calorimeter shower modeling train separate networks for each particle species, limiting scalability and reuse. We introduce AllShowers, a unified generative model that simulates calorimeter showers across multiple particle types using a single generative model. AllShowers is a continuous normalizing flow model with a Transformer architecture, enabling it to generate complex spatial and energy correlations in variable-length point cloud representations of showers. Trained on a diverse dataset of simulated showers in the highly granular ILD detector, the model demonstrates the ability to generate realistic showers for electrons, photons, and charged and neutral hadrons across a wide range of incident energies and angles without retraining. In addition to unifying shower generation for multiple particle types, AllShowers surpasses the fidelity of previous single-particle-type models for hadronic showers. Key innovations include the use of a layer embedding, allowing the model to learn all relevant calorimeter layer properties; a custom attention masking scheme to reduce computational demands and introduce a helpful inductive bias; and a shower- and layer-wise optimal transport mapping to improve training convergence and sample quality. AllShowers marks a significant step towards a universal model for calorimeter shower simulations in collider experiments.

Thorsten Buss, Henry Day-Hall, Frank Gaede +2

Institut für Experimentalphysik, Universität Hamburg, Hamburg, Germany · Deutsches Elektronen-Synchrotron DESY, Hamburg, Germany

Generative Models Surrogate Models

Dec 12, 2025cond-mat.stat-mech

Emergence of Nonequilibrium Latent Cycles in Unsupervised Generative Modeling

We show that nonequilibrium dynamics can play a constructive role in unsupervised machine learning by inducing the spontaneous emergence of latent-state cycles. We introduce a model in which visible and hidden variables interact through two independently parametrized transition matrices, defining a Markov chain whose steady state is intrinsically out of equilibrium. Likelihood maximization drives this system toward nonequilibrium steady states with finite entropy production, reduced self-transition probabilities, and persistent probability currents in the latent space. These cycles are not imposed by the architecture but arise from training, and models that develop them reproduce the empirical distribution of data classes more faithfully, with a clear correlation between agreement with the data and entropy production. Compared with equilibrium approaches such as restricted Boltzmann machines, our model breaks the detailed balance between the forward and backward conditional transitions and relies on a log-likelihood gradient that depends explicitly on the last two steps of the Markov chain. Hence, this exploration of the interface between nonequilibrium statistical physics and modern machine learning suggests that introducing irreversibility into latent-variable models can improve the fidelity of the generated data distribution.

Marco Baiesi, Alberto Rosso

Department of Physics and Astronomy, University of Padova, Via Marzolo 8, I-35131 Padova, Italy · INFN, Sezione di Padova, Via Marzolo 8, I-35131 Padova, Italy · LPTMS, CNRS, Universit´e Paris-Saclay, 91405, Orsay, France

Statistical Physics Generative Models Latent States Emergence Chronos

Dec 8, 2025cs.CV

Distribution Matching Variational AutoEncoder

Most visual generative models compress images into a latent space before applying diffusion or autoregressive modelling. Yet, existing approaches such as VAEs and foundation model aligned encoders implicitly constrain the latent space without explicitly shaping its distribution, making it unclear which types of distributions are optimal for modeling. We introduce \textbf{Distribution-Matching VAE} (\textbf{DMVAE}), which explicitly aligns the encoder's latent distribution with an arbitrary reference distribution via a distribution matching constraint. This generalizes beyond the Gaussian prior of conventional VAEs, enabling alignment with distributions derived from self-supervised features, diffusion noise, or other prior distributions. With DMVAE, we can systematically investigate which latent distributions are more conducive to modeling, and we find that SSL-derived distributions provide an excellent balance between reconstruction fidelity and modeling efficiency, reaching gFID equals 3.2 on ImageNet with only 64 training epochs. Our results suggest that choosing a suitable latent distribution structure (achieved via distribution-level alignment), rather than relying on fixed priors, is key to bridging the gap between easy-to-model latents and high-fidelity image synthesis. Code is avaliable at https://github.com/sen-ye/dmvae.

Sen Ye, Jianning Pei, Mengde Xu +4

State Key Laboratory of General Artificial Intelligence, School of Intelligence Science and Technology, Peking University · University of Chinese Academy of Sciences · Tencent +1

Conditional Variational Autoencoder Generative Models Distributions

Nov 27, 2025cs.CV

Z-Image: An Efficient Image Generation Foundation Model with Single-Stream Diffusion Transformer

The landscape of high-performance image generation models is currently dominated by proprietary systems, such as Nano Banana Pro and Seedream 4.0. Leading open-source alternatives, including Qwen-Image, Hunyuan-Image-3.0 and FLUX.2, are characterized by massive parameter counts (20B to 80B), making them impractical for inference, and fine-tuning on consumer-grade hardware. To address this gap, we propose Z-Image, an efficient 6B-parameter foundation generative model built upon a Scalable Single-Stream Diffusion Transformer (S3-DiT) architecture that challenges the "scale-at-all-costs" paradigm. By systematically optimizing the entire model lifecycle -- from a curated data infrastructure to a streamlined training curriculum -- we complete the full training workflow in just 314K H800 GPU hours (approx. $630K). Our few-step distillation scheme with reward post-training further yields Z-Image-Turbo, offering both sub-second inference latency on an enterprise-grade H800 GPU and compatibility with consumer-grade hardware (<16GB VRAM). Additionally, our omni-pre-training paradigm also enables efficient training of Z-Image-Edit, an editing model with impressive instruction-following capabilities. Both qualitative and quantitative experiments demonstrate that our model achieves performance comparable to or surpassing that of leading competitors across various dimensions. Most notably, Z-Image exhibits exceptional capabilities in photorealistic image generation and bilingual text rendering, delivering results that rival top-tier commercial models, thereby demonstrating that state-of-the-art results are achievable with significantly reduced computational overhead. We publicly release our code, weights, and online demo to foster the development of accessible, budget-friendly, yet state-of-the-art generative models.

Z-Image Team, Huanqia Cai, Sihan Cao +21

Z-Image Team, Alibaba Group

Multi-Reference Image Generation Image Generation Diffusion Transformers Single-Cell Foundation Models Generative Models Query Image

Nov 25, 2025cs.CV

Learning to Generate Human-Human-Object Interactions from Textual Descriptions

The way humans interact with each other, including interpersonal distances, spatial configuration, and motion, varies significantly across different situations. To enable machines to understand such complex, context-dependent behaviors, it is essential to model multiple people in relation to the surrounding scene context. In this paper, we present a novel research problem to model the correlations between two people engaged in a shared interaction involving an object. We refer to this formulation as Human-Human-Object Interactions (HHOIs). To overcome the lack of dedicated datasets for HHOIs, we present a newly captured HHOIs dataset and a method to synthesize HHOI data by leveraging image generative models. As an intermediary, we obtain individual human-object interaction (HOIs) and human-human interaction (HHIs) from the HHOIs, and with these data, we train an text-to-HOI and text-to-HHI model using score-based diffusion model. Finally, we present a unified generative framework that integrates the two individual model, capable of synthesizing complete HHOIs in a single advanced sampling process. Our method extends HHOI generation to multi-human settings, enabling interactions involving more than two individuals. Experimental results show that our method generates realistic HHOIs conditioned on textual descriptions, outperforming previous approaches that focus only on single-human HOIs. Furthermore, we introduce multi-human motion generation involving objects as an application of our framework.

Jeonghyeon Na, Sangwon Baik, Inhee Lee +2

Seoul National University

Articulated Objects Human Motion Generation Multimodal Generation Generative Models Score-Based Diffusion Model

Nov 22, 2025cs.CV

FeRA: Frequency-Energy Constrained Routing for Effective Diffusion Adaptation Fine-Tuning

Diffusion models have achieved remarkable success in generative modeling, yet how to effectively adapt large pretrained models to new tasks remains challenging. We revisit the reconstruction behavior of diffusion models during denoising to unveil the underlying frequency energy mechanism governing this process. Building upon this observation, we propose FeRA, a frequency driven fine tuning framework that aligns parameter updates with the intrinsic frequency energy progression of diffusion. FeRA establishes a comprehensive frequency energy framework for effective diffusion adaptation fine tuning, comprising three synergistic components: (i) a compact frequency energy indicator that characterizes the latent bandwise energy distribution, (ii) a soft frequency router that adaptively fuses multiple frequency specific adapter experts, and (iii) a frequency energy consistency regularization that stabilizes diffusion optimization and ensures coherent adaptation across bands. Routing operates in both training and inference, with inference time routing dynamically determined by the latent frequency energy. It integrates seamlessly with adapter based tuning schemes and generalizes well across diffusion backbones and resolutions. By aligning adaptation with the frequency energy mechanism, FeRA provides a simple, stable, and compatible paradigm for effective and robust diffusion model adaptation.

Bo Yin, Xiaobin Hu, Xingyu Zhou +7

National University of Singapore · University of Electronic Science and Technology of China · Nanyang Technological University +4

Diffusion Models Model Fine-Tuning Generative Models Regularization

Nov 11, 2025stat.ML

Concentration bounds on response-based vector embeddings of black-box generative models

Generative models, such as large language models or text-to-image diffusion models, can generate relevant responses to user-given queries. Response-based vector embeddings of generative models facilitate statistical analysis and inference on a given collection of black-box generative models. The Data Kernel Perspective Space embedding is one particular method of obtaining response-based vector embeddings for a given set of generative models, already discussed in the literature. In this paper, under appropriate regularity conditions, we establish high probability concentration bounds on the sample vector embeddings for a given set of generative models, obtained through the method of Data Kernel Perspective Space embedding. Our results tell us the required number of sample responses needed in order to approximate the population-level vector embeddings with a desired level of accuracy. The algebraic tools used to establish our results can be used further for establishing concentration bounds on Classical Multidimensional Scaling embeddings in general, when the dissimilarities are observed with noise.

Aranyak Acharyya, Joshua Agterberg, Youngser Park +1

Generative Models Behavioral Embeddings Text Embeddings Concentration Bounds

Nov 4, 2025cs.LG

Leveraging Discrete Function Decomposability for Scientific Design

In the era of AI-driven science and engineering, we often want to design discrete objects in silico according to user-specified properties. For example, we may wish to design a protein to bind its target, arrange components within a circuit to minimize latency, or find materials with certain properties. Given a property predictive model, in silico design typically involves training a generative model over the design space (e.g., protein sequence space) to concentrate on designs with the desired properties. Distributional optimization

\unicode{x2013}

which can be formalized as an estimation of distribution algorithm or as reinforcement learning policy optimization

\unicode{x2013}

finds the generative model that maximizes an objective function in expectation. Optimizing a distribution over discrete-valued designs is in general challenging because of the combinatorial nature of the design space. However, many property predictors in scientific applications are decomposable in the sense that they can be factorized over design variables in a way that could in principle enable more effective optimization. For example, amino acids at a catalytic site of a protein may only loosely interact with amino acids of the rest of the protein to achieve maximal catalytic activity. Current distributional optimization algorithms are unable to make use of such decomposability structure. Herein, we propose and demonstrate use of a new distributional optimization algorithm, Decomposition-Aware Distributional Optimization (DADO), that can leverage any decomposability defined by a junction tree on the design variables, to make optimization more efficient. At its core, DADO employs a soft-factorized "search distribution"

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a learned generative model

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for efficient navigation of the search space, invoking graph message-passing to coordinate optimization across linked factors.

James C. Bowden, Sergey Levine, Jennifer Listgarten

Department of Electrical Engineering and Computer Sciences, UC Berkeley. · Center for Computational Biology, UC Berkeley. · UC Berkeley–UCSF Graduate Program in Bioengineering, UC San Francisco.

Optimal Design Decentralized Optimization Decomposition Scientific Discovery Generative Models

Oct 29, 2025cs.SE

Metamodel-Guided Model Generation with Layered Constraints

Large language models (LLMs) enable natural-language interaction in engineering modeling, but generated models may violate structural constraints, domain rules, or task requirements. We propose a metamodel-guided model generation method that coordinates generation-time constraints and post-generation validation. The method transforms metamodel information, uses its terminology to guide structured constraint extraction from specifications, and links constraints to metamodel elements while recording their sources in an Integrated Constraint Model (ICM). For each task, relevant constraints are bound to concrete objects, values, and references. The generation-time constraint layer (L1) restricts candidate content. The post-generation validation layer (L2) checks constructed models and serialized artifacts, and task acceptance checks retain the original requirements throughout repair. Deterministic procedures construct and serialize models, while LLMs propose candidate content and repairs. Validation uses existing domain tools and checkers written by humans with LLM assistance. Experiments cover AUTOSAR, railway models, and structured decisions in private international law. All 60 AUTOSAR generation runs passed acceptance within the declared task scope, and all 255 resulting ARXML files passed XSD validation. In a separate controlled AUTOSAR repair experiment, all 85 core fault units and 15 prespecified substitute units were restored within one repair round. A local AUTOSAR experiment recorded interventions during stepwise generation. The results support coordinating generation constraints, domain checks, and task acceptance to construct models and guide bounded repair.

Tong Ma, Hui Lai, Hui Wang +4

University of Science and Technology of China, China · Hefei Institutes of Physical Science, Chinese Academy of Sciences, China · Anhui University, China

Large Language Model Generation Constraint Satisfaction Generative Models Structural Constraints Repair Validation

Oct 29, 2025cs.LG

CDFlow: Building Invertible Layers with Circulant and Diagonal Matrices

Normalizing flows are deep generative models that enable efficient likelihood estimation and sampling through invertible transformations. A key challenge is to design linear layers that enhance expressiveness while maintaining efficient computation of the Jacobian determinant and inverse. We introduce a novel invertible linear layer based on the product of circulant and diagonal matrices. This decomposition reduces parameter complexity from

\mathcal{O}(n^2)

to

\mathcal{O}(mn)

using

m

diagonal matrices and

m-1

circulant matrices while still approximating general linear transformations. By leveraging the Fast Fourier Transform, our approach reduces the time complexity of matrix inversion from

\mathcal{O}(n^3)

to

\mathcal{O}(mn\log n)

and that of computing the log-determinant from

\mathcal{O}(n^3)

to

\mathcal{O}(mn)

, where

n

is the input dimension. We build upon this layer to develop Circulant-Diagonal Flow (CDFlow), which achieves strong density estimation on natural image datasets and effectively models data with inherent periodic structure. Furthermore, CDFlow significantly accelerates key operations in normalizing flows, providing practical benefits for scalable generative modeling.

Xuchen Feng, Siyu Liao

School of Integrated Circuits Sun Yat-sen University

Normalizing Flows Batch Normalization Equivariant Neural Networks Final Convolutional Layers Generative Models

Oct 28, 2025cs.CV

VividCam: Learning Unconventional Camera Motions from Virtual Synthetic Videos

Although recent video generative models are getting more capable of following external camera controls, imposed by either text descriptions or camera trajectories, they still struggle to generalize to unconventional camera motions, which is crucial in creating truly original and artistic videos. The challenge lies in finding sufficient training videos with the intended uncommon camera motions. To this end, we propose VividCam, a training paradigm that enables diffusion models to learn complex camera motions from synthetic videos, releasing the reliance on collecting realistic training videos. VividCam incorporates multiple disentanglement strategies that isolate camera motion learning from synthetic appearance artifacts, ensuring more robust motion representation and mitigating domain shift. We show that our design synthesizes a wide range of precisely controlled camera motions using surprisingly simple synthetic data. Notably, this synthetic data often consists of basic geometries within a low-poly 3D scene and can be efficiently rendered by engines like Unity. Our video results can be found in https://wuqiuche.github.io/VividCamDemoPage/ .

Qiucheng Wu, Handong Zhao, Zhixin Shu +3

UC, Santa Barbara · Adobe Research · MIT-IBM Watson AI Lab

Camera Control Camera Trajectories Camera Generative Models

Oct 18, 2025stat.ML

Escaping Model Collapse via Synthetic Data Verification: Near-term Improvements and Long-term Convergence

Synthetic data has been increasingly used to train frontier generative models. However, recent studies raise key concerns that iteratively retraining a generative model on its self-generated synthetic data may keep deteriorating model performance, a phenomenon often coined model collapse. In this paper, we investigate ways to modify the synthetic retraining process to avoid model collapse, and even possibly help reverse the trend from collapse to improvement. Our key finding is that by injecting information through an external synthetic data verifier, whether a human or a better model, synthetic retraining will not cause model collapse. Specifically, we situate our theoretical analysis in the fundamental linear regression setting, showing that verifier-guided retraining can yield near-term improvements, but ultimately drives the parameter estimate to the verifier's "knowledge center" in the long run. Our theory further predicts that, unless the verifier is perfectly reliable, these early gains will plateau and may even reverse. Indeed, our experiments across linear regression, Variational Autoencoders (VAEs) trained on MNIST, and fining-tuning SmolLM2-135M on the XSUM task confirm these theoretical insights.

Bingji Yi, Qiyuan Liu, Yuwei Cheng +1

Independent Researcher. Work done while visiting UChicago CS. · Work done while visiting UChicago CS. · Department of Statistics, University of Chicago. +1

Synthetic Data Retraining Collapse Generative Models Convergence

Oct 14, 2025cs.LG

Attribution Graphs and Causal Probing for Mechanistic Discovery and Bias Repair in Multimodal Generative Learning

We treat the internals of generative models as mechanistic objects rather than black boxes. We introduce \textbf{Attribution Graphs} (AGs), which extend GradCAM++ to circuit-level representations, and \textbf{Causal Probing}, a do-calculus intervention method for identifying causal latent structures, enabling detection and correction of spurious correlations, demographic biases, and misaligned decision circuits during training. We further propose the \textbf{Cognitive Alignment Score (CAS)}, quantifying agreement between model-internal representations and human concepts, a \textbf{saliency-first privacy mechanism} sharing only thresholded attribution nodes, a bias-aware regularizer aligning subgroup statistics, and a Reveal-to-Revise loop integrating attribution signals into parameter updates without separate fine-tuning. Evaluated on CelebA, FairFace, Jigsaw, and HateXplain, our method achieves \textbf{94.1%} accuracy, \textbf{92.3%} macro F1, \textbf{79.4%} IoU-XAI, and \textbf{12.7} FID at 72--76% adversarial robustness, while reducing subgroup disparity

Δ_{\mathrm{bias}}

by \textbf{41%}, demonstrating that mechanistic interpretability, fairness, and generative performance can be jointly optimized.

Noor Islam S. Mohammad, Uluğ Bayazıt

1,2Istanbul Technical University

Mechanistic Interpretability Causal Representation Learning Generative Models Multimodal Generation Cognitive Science

Oct 10, 2025cs.LG

BaNEL: Exploration Posteriors for Generative Modeling Using Only Negative Rewards

Today's generative models thrive with large amounts of supervised data and informative reward functions characterizing the quality of the generation. They work under the assumptions that the supervised data provides knowledge to pre-train the model, and the reward function provides dense information about how to further improve the generation quality and correctness. However, in the hardest instances of important problems, two problems arise: (1) the base generative model attains a near-zero reward signal, and (2) calls to the reward oracle are expensive. This setting poses a fundamentally different learning challenge than standard reward-based post-training. To address this, we propose BaNEL (Bayesian Negative Evidence Learning), an algorithm that post-trains the model using failed attempts only, while minimizing the number of reward evaluations (NREs). Our method is based on the idea that the problem of learning regularities underlying failures can be cast as another, in-loop generative modeling problem. We then leverage this model to assess whether new data resembles previously seen failures and steer the generation away from them. We show that BaNEL can improve model performance without observing a single successful sample on several sparse-reward tasks, outperforming existing novelty-bonus approaches by up to several orders of magnitude in success rate, while using fewer reward evaluations.

Sangyun Lee, Brandon Amos, Giulia Fanti

Carnegie Mellon University

Generative Models Progress Reward Modeling Reinforcement Learning Post-Training Posterior Post-Training Exploration