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Applications · Computer Vision

Jiayi Liu, Denys Iliash, Angel Chang, Manolis Savva, Ali Mahdavi Amiri

We address the challenge of creating 3D assets for household articulated objects from a single image.Prior work on articulated object creation either requires multi-view multi-state input, or only allows coarse control over the generation process.These limitations hinder the scalability and practicality for articulated object modeling.In this work, we propose a method to generate articulated objects from a single image.Observing the object in a resting state from an arbitrary view, our method generates an articulated object that is visually consistent with the input image.To capture the ambiguity in part shape and motion posed by a single view of the object, we design a diffusion model that learns the plausible variations of objects in terms of geometry and kinematics.To tackle the complexity of generating structured data with attributes in multiple domains, we design a pipeline that produces articulated objects from high-level structure to geometric details in a coarse-to-fine manner, where we use a part connectivity graph and part abstraction as proxies.Our experiments show that our method outperforms the state-of-the-art in articulated object creation by a large margin in terms of the generated object realism, resemblance to the input image, and reconstruction quality.

Gen Li, Yuling Yan

Score-based diffusion models, which generate new data by learning to reverse a diffusion process that perturbs data from the target distribution into noise, have achieved remarkable success across various generative tasks. Despite their superior empirical performance, existing theoretical guarantees are often constrained by stringent assumptions or suboptimal convergence rates. In this paper, we establish a fast convergence theory for the denoising diffusion probabilistic model (DDPM), a widely used SDE-based sampler, under minimal assumptions. Our analysis shows that, provided $\ell_{2}$-accurate estimates of the score functions, the total variation distance between the target and generated distributions is upper bounded by $O(d/T)$ (ignoring logarithmic factors), where $d$ is the data dimensionality and $T$ is the number of steps. This result holds for any target distribution with finite first-order moment. To our knowledge, this improves upon existing convergence theory for the DDPM sampler, while imposing minimal assumptions on the target data distribution and score estimates. This is achieved through a novel set of analytical tools that provides a fine-grained characterization of how the error propagates at each step of the reverse process.

Deep Learning · Generative Models and Autoencoders

Tianqi Chen, Shujian Zhang, Mingyuan Zhou

The machine learning community is increasingly recognizing the importance of fostering trust and safety in modern generative AI (GenAI) models. We posit machine unlearning (MU) as a crucial foundation for developing safe, secure, and trustworthy GenAI models. Traditional MU methods often rely on stringent assumptions and require access to real data. This paper introduces Score Forgetting Distillation (SFD), an innovative MU approach that promotes the forgetting of undesirable information in diffusion models by aligning the conditional scores of "unsafe" classes or concepts with those of "safe" ones. To eliminate the need for real data, our SFD framework incorporates a score-based MU loss into the score distillation objective of a pretrained diffusion model. This serves as a regularization term that preserves desired generation capabilities while enabling the production of synthetic data through a one-step generator. Our experiments on pretrained label-conditional and text-to-image diffusion models demonstrate that our method effectively accelerates the forgetting of target classes or concepts during generation, while preserving the quality of other classes or concepts. This unlearned and distilled diffusion not only pioneers a novel concept in MU but also accelerates the generation speed of diffusion models. Our experiments and studies on a range of diffusion models and datasets confirm that our approach is generalizable, effective, and advantageous for MU in diffusion models. Code is available at [https://github.com/tqch/score-forgetting-distillation](https://github.com/tqch/score-forgetting-distillation). (**Warning:** This paper contains sexually explicit imagery, discussions of pornography, racially-charged terminology, and other content that some readers may find disturbing, distressing, and/or offensive.)

Deep Learning · Large Language Models

Chunting Zhou, Lili Yu, Arun Babu, Kushal Tirumala, Michihiro Yasunaga, Leonid Shamis, Jacob Kahn, Xuezhe Ma, Luke Zettlemoyer, Omer Levy

We introduce Transfusion, a recipe for training a multi-modal model over discrete and continuous data.Transfusion combines the language modeling loss function (next token prediction) with diffusion to train a single transformer over mixed-modality sequences.We pretrain multiple Transfusion models up to 7B parameters from scratch on a mixture of text and image data, establishing scaling laws with respect to a variety of uni- and cross-modal benchmarks.Our experiments show that Transfusion scales significantly better than quantizing images and training a language model over discrete image tokens.By introducing modality-specific encoding and decoding layers, we can further improve the performance of Transfusion models, and even compress each image to just 16 patches.We further demonstrate that scaling our Transfusion recipe to 7B parameters and 2T multi-modal tokens produces a model that can generate images and text on a par with similar scale diffusion models and language models, reaping the benefits of both worlds.

Deep Learning · Large Language Models

Chunting Zhou, Lili Yu, Arun Babu, Kushal Tirumala, Michihiro Yasunaga, Leonid Shamis, Jacob Kahn, Xuezhe Ma, Luke Zettlemoyer, Omer Levy

We introduce Transfusion, a recipe for training a multi-modal model over discrete and continuous data.Transfusion combines the language modeling loss function (next token prediction) with diffusion to train a single transformer over mixed-modality sequences.We pretrain multiple Transfusion models up to 7B parameters from scratch on a mixture of text and image data, establishing scaling laws with respect to a variety of uni- and cross-modal benchmarks.Our experiments show that Transfusion scales significantly better than quantizing images and training a language model over discrete image tokens.By introducing modality-specific encoding and decoding layers, we can further improve the performance of Transfusion models, and even compress each image to just 16 patches.We further demonstrate that scaling our Transfusion recipe to 7B parameters and 2T multi-modal tokens produces a model that can generate images and text on a par with similar scale diffusion models and language models, reaping the benefits of both worlds.

Deep Learning · Graph Neural Networks

Mario Lino, Tobias Pfaff, Nils Thuerey

Physical systems with complex unsteady dynamics, such as fluid flows, are often poorly represented by a single mean solution. For many practical applications, it is crucial to access the full distribution of possible states, from which relevant statistics (e.g., RMS and two-point correlations) can be derived. Here, we propose a graph-based latent diffusion model that enables direct sampling of states from their equilibrium distribution, given a mesh discretization of the system and its physical parameters. This allows for the efficient computation of flow statistics without running long and expensive numerical simulations. The graph-based structure enables operations on unstructured meshes, which is critical for representing complex geometries with spatially localized high gradients, while latent-space diffusion modeling with a multi-scale GNN allows for efficient learning and inference of entire distributions of solutions. A key finding of our work is that the proposed networks can accurately learn full distributions even when trained on incomplete data from relatively short simulations. We apply this method to a range of fluid dynamics tasks, such as predicting pressure distributions on 3D wing models in turbulent flow, demonstrating both accuracy and computational efficiency in challenging scenarios. The ability to directly sample accurate solutions, and capturing their diversity from short ground-truth simulations, is highly promising for complex scientific modeling tasks.

Applications · Chemistry and Drug Discovery

Gyoung S. Na, Chanyoung Park

Physical properties derived from electronic distributions are essential information that determines molecular properties. However, the electron-level information is not accessible in most real-world complex molecules due to the extensive computational costs of determining uncertain electronic distributions. For this reason, existing methods for molecular property prediction have remained in regression models on simplified atom-level molecular descriptors, such as atomic structures and fingerprints. This paper proposes an efficient knowledge transfer method for electron-aware molecular representation learning. To this end, we devised a self-supervised diffusion method that estimates the electron-level information of real-world complex molecules without expensive quantum mechanical calculations. The proposed method achieved state-of-the-art prediction accuracy in the tasks of predicting molecular properties on extensive real-world molecular datasets.

Applications · Computer Vision

Yushi LAN, Shangchen Zhou, Zhaoyang Lyu, Fangzhou Hong, Shuai Yang, Bo DAI, Xingang Pan, Chen Change Loy

Recent advancements in diffusion models and large-scale datasets have revolutionized image and video generation, with increasing focus on 3D content generation. While existing methods show promise, they face challenges in input formats, latent space structures, and output representations. This paper introduces a novel 3D generation framework that addresses these issues, enabling scalable and high-quality 3D generation with an interactive Point Cloud-structured Latent space. Our approach utilizes a VAE with multi-view posed RGB-D-N renderings as input, features a unique latent space design that preserves 3D shape information, and incorporates a cascaded latent flow-based model for improved shape-texture disentanglement. The proposed method, GaussianAnything, supports multi-modal conditional 3D generation, allowing for point cloud, caption, and single-view image inputs. Experimental results demonstrate superior performance on various datasets, advancing the state-of-the-art in 3D content generation.

Deep Learning · Generative Models and Autoencoders

GIORGIA MINELLO, Alessandro Bicciato, Luca Rossi, Andrea Torsello, Luca Cosmo

In this paper, we present GGSD, a novel graph generative model based on 1) the spectral decomposition of the graph Laplacian matrix and 2) a diffusion process. Specifically, we propose to use a denoising model to sample eigenvectors and eigenvalues from which we can reconstruct the graph Laplacian and adjacency matrix. Using the Laplacian spectrum allows us to naturally capture the structural characteristics of the graph and work directly in the node space while avoiding the quadratic complexity bottleneck that limits the applicability of other diffusion-based methods. This, in turn, is accomplished by truncating the spectrum, which, as we show in our experiments, results in a faster yet accurate generative process, and by designing a novel transformer-based architecture linear in the number of nodes. Our permutation invariant model can also handle node features by concatenating them to the eigenvectors of each node. An extensive set of experiments on both synthetic and real-world graphs demonstrates the strengths of our model against state-of-the-art alternatives.

Lvmin Zhang, Anyi Rao, Maneesh Agrawala

Diffusion-based image generators are becoming unique methods for illumination harmonization and editing. The current bottleneck in scaling up the training of diffusion-based illumination editing models is mainly in the difficulty of preserving the underlying image details and maintaining intrinsic properties, such as albedos, unchanged. Without appropriate constraints, directly training the latest large image models with complex, varied, or in-the-wild data is likely to produce a structure-guided random image generator, rather than achieving the intended goal of precise illumination manipulation. We propose Imposing Consistent Light (IC-Light) transport during training, rooted in the physical principle that the linear blending of an object's appearances under different illumination conditions is consistent with its appearance under mixed illumination. This consistency allows for stable and scalable illumination learning, uniform handling of various data sources, and facilitates a physically grounded model behavior that modifies only the illumination of images while keeping other intrinsic properties unchanged. Based on this method, we can scale up the training of diffusion-based illumination editing models to large data quantities (> 10 million), across all available data types (real light stages, rendered samples, in-the-wild synthetic augmentations, etc), and using strong backbones (SDXL, Flux, etc). We also demonstrate that this approach reduces uncertainties and mitigates artifacts such as mismatched materials or altered albedos.

Applications · Computer Vision

Lvmin Zhang, Anyi Rao, Maneesh Agrawala

Diffusion-based image generators are becoming unique methods for illumination harmonization and editing. The current bottleneck in scaling up the training of diffusion-based illumination editing models is mainly in the difficulty of preserving the underlying image details and maintaining intrinsic properties, such as albedos, unchanged. Without appropriate constraints, directly training the latest large image models with complex, varied, or in-the-wild data is likely to produce a structure-guided random image generator, rather than achieving the intended goal of precise illumination manipulation. We propose Imposing Consistent Light (IC-Light) transport during training, rooted in the physical principle that the linear blending of an object's appearances under different illumination conditions is consistent with its appearance under mixed illumination. This consistency allows for stable and scalable illumination learning, uniform handling of various data sources, and facilitates a physically grounded model behavior that modifies only the illumination of images while keeping other intrinsic properties unchanged. Based on this method, we can scale up the training of diffusion-based illumination editing models to large data quantities (> 10 million), across all available data types (real light stages, rendered samples, in-the-wild synthetic augmentations, etc), and using strong backbones (SDXL, Flux, etc). We also demonstrate that this approach reduces uncertainties and mitigates artifacts such as mismatched materials or altered albedos.

Deep Learning · Generative Models and Autoencoders

Sabine Susstrunk, Mathieu Salzmann, Chen Liu, Hieu Le, Shuangqi Li, Tong Zhang

We introduce an approach to bias deep generative models, such as GANs and diffusion models, towards generating data with either enhanced fidelity or increased diversity. Our approach involves manipulating the distribution of training and generated data through a novel metric for individual samples, named pseudo density, which is based on the nearest-neighbor information from real samples. Our approach offers three distinct techniques to adjust the fidelity and diversity of deep generative models: 1) Per-sample perturbation, enabling precise adjustments for individual samples towards either more common or more unique characteristics; 2) Importance sampling during model inference to enhance either fidelity or diversity in the generated data; 3) Fine-tuning with importance sampling, which guides the generative model to learn an adjusted distribution, thus controlling fidelity and diversity. Furthermore, our fine-tuning method demonstrates the ability to improve the Frechet Inception Distance (FID) for pre-trained generative models with minimal iterations.

Deep Learning · Generative Models and Autoencoders

Fu-Yun Wang, Yunhao Shui, Jingtan Piao, Keqiang Sun, Hongsheng Li

Diffusion models have made substantial advances in image generation, yet models trained on large, unfiltered datasets often yield outputs misaligned with human preferences. Numerous methods have already been proposed to fine-tune pre-trained diffusion models, achieving notable improvements in aligning generated outputs with human preferences. However, we point out that existing preference alignment methods neglect the critical role of handling unconditional/negative-conditional outputs, leading to a diminished capacity to avoid generating undesirable outcomes. This oversight limits the efficacy of classifier-free guidance (CFG), which relies on the contrast between conditional generation and unconditional/negative-conditional generation to optimize output quality. In response, we propose a straightforward but consistently effective approach that involves training a model specifically attuned to negative preferences. This method does not require new training strategies or datasets but rather involves minor modifications to existing techniques. Our approach integrates seamlessly with models such as SD15, SDXL, video diffusion models and models that have undergone preference optimization, consistently enhancing their ability to produce more human preferences aligned outputs.

Applications · Chemistry and Drug Discovery

Mohamed Amine Ketata, Nicholas Gao, Johanna Sommer, Tom Wollschläger, Stephan Günnemann

We introduce a new framework for 2D molecular graph generation using 3D molecule generative models. Our Synthetic Coordinate Embedding (SyCo) framework maps 2D molecular graphs to 3D Euclidean point clouds via synthetic coordinates and learns the inverse map using an E($n$)-Equivariant Graph Neural Network (EGNN). The induced point cloud-structured latent space is well-suited to apply existing 3D molecule generative models. This approach simplifies the graph generation problem into a point cloud generation problem followed by node and edge classification tasks, without relying on molecular fragments nor autoregressive decoding. Further, we propose a novel similarity-constrained optimization scheme for 3D diffusion models based on inpainting and guidance. As a concrete implementation of our framework, we develop EDM-SyCo based on the E(3) Equivariant Diffusion Model (EDM). EDM-SyCo achieves state-of-the-art performance in distribution learning of molecular graphs, outperforming the best non-autoregressive methods by more than 26\% on ZINC250K and 16\% on the GuacaMol dataset while improving conditional generation by up to 3.9 times.

Applications · Computer Vision

Xiaojian Lin, Hanhui Li, Yuhao Cheng, Yiqiang Yan, Xiaodan Liang

Recent interactive point-based image manipulation methods have gained considerable attention for being user-friendly. However, these methods still face two types of ambiguity issues that can lead to unsatisfactory outcomes, namely, intention ambiguity which misinterprets the purposes of users, and content ambiguity where target image areas are distorted by distracting elements. To address these issues and achieve general-purpose manipulations, we propose a novel task-aware, training-free framework called GDrag. Specifically, GDrag defines a taxonomy of atomic manipulations, which can be parameterized and combined unitedly to represent complex manipulations, thereby reducing intention ambiguity. Furthermore, GDrag introduces two strategies to mitigate content ambiguity, including an anti-ambiguity dense trajectory calculation method (ADT) and a self-adaptive motion supervision method (SMS). Given an atomic manipulation, ADT converts the sparse user-defined handle points into a dense point set by selecting their semantic and geometric neighbors, and calculates the trajectory of the point set. Unlike previous motion supervision methods relying on a single global scale for low-rank adaption, SMS jointly optimizes point-wise adaption scales and latent feature biases. These two methods allow us to model fine-grained target contexts and generate precise trajectories. As a result, GDrag consistently produces precise and appealing results in different editing tasks. Extensive experiments on the challenging DragBench dataset demonstrate that GDrag outperforms state-of-the-art methods significantly. The code of GDrag will be released upon acceptance.

Peter Holderrieth, Marton Havasi, Jason Yim, Neta Shaul, Itai Gat, Tommi Jaakkola, Brian Karrer, Ricky T. Q. Chen, Yaron Lipman

We introduce Generator Matching, a modality-agnostic framework for generative modeling using arbitrary Markov processes. Generators characterize the infinitesimal evolution of a Markov process, which we leverage for generative modeling in a similar vein to flow matching: we construct conditional generators which generate single data points, then learn to approximate the marginal generator which generates the full data distribution. We show that Generator Matching unifies various generative modeling methods, including diffusion models, flow matching and discrete diffusion models. Furthermore, it expands the design space to new and unexplored Markov processes such as jump processes. Finally, Generator Matching enables the construction of superpositions of Markov generative models and enables the construction of multimodal models in a rigorous manner. We empirically validate our method on image and multimodal generation, e.g. showing that superposition with a jump process improves performance.

Probabilistic Methods · Monte Carlo and Sampling Methods

Denis Blessing, Julius Berner, Lorenz Richter, Gerhard Neumann

We provide a general framework for learning diffusion bridges that transport prior to target distributions. It includes existing diffusion models for generative modeling, but also underdamped versions with degenerate diffusion matrices, where the noise only acts in certain dimensions. Extending previous findings, our framework allows to rigorously show that score-matching in the underdamped case is indeed equivalent to maximizing a lower bound on the likelihood. Motivated by superior convergence properties and compatibility with sophisticated numerical integration schemes of underdamped stochastic processes, we propose *underdamped diffusion bridges*, where a general density evolution is learned rather than prescribed by a fixed noising process. We apply our method to the challenging task of sampling from unnormalized densities without access to samples from the target distribution. Across a diverse range of sampling problems, our approach demonstrates state-of-the-art performance, notably outperforming alternative methods, while requiring significantly fewer discretization steps and almost no hyperparameter tuning.

Deep Learning · Generative Models and Autoencoders

Peter Holderrieth, Marton Havasi, Jason Yim, Neta Shaul, Itai Gat, Tommi Jaakkola, Brian Karrer, Ricky T. Q. Chen, Yaron Lipman

We introduce Generator Matching, a modality-agnostic framework for generative modeling using arbitrary Markov processes. Generators characterize the infinitesimal evolution of a Markov process, which we leverage for generative modeling in a similar vein to flow matching: we construct conditional generators which generate single data points, then learn to approximate the marginal generator which generates the full data distribution. We show that Generator Matching unifies various generative modeling methods, including diffusion models, flow matching and discrete diffusion models. Furthermore, it expands the design space to new and unexplored Markov processes such as jump processes. Finally, Generator Matching enables the construction of superpositions of Markov generative models and enables the construction of multimodal models in a rigorous manner. We empirically validate our method on image and multimodal generation, e.g. showing that superposition with a jump process improves performance.

Deep Learning · Generative Models and Autoencoders

Sihyun Yu, Sangkyung Kwak, Huiwon Jang, Jongheon Jeong, Jonathan Huang, Jinwoo Shin, Saining Xie

Recent studies have shown that the denoising process in (generative) diffusion models can induce meaningful (discriminative) representations inside the model, though the quality of these representations still lags behind those learned through recent self-supervised learning methods. We argue that one main bottleneck in training large-scale diffusion models for generation lies in effectively learning these representations. Moreover, training can be made easier by incorporating high-quality external visual representations, rather than relying solely on the diffusion models to learn them independently. We study this by introducing a straightforward regularization called REPresentation Alignment (REPA), which aligns the projections of noisy input hidden states in denoising networks with clean image representations obtained from external, pretrained visual encoders. The results are striking: our simple strategy yields significant improvements in both training efficiency and generation quality when applied to popular diffusion and flow-based transformers, such as DiTs and SiTs. For instance, our method can speed up SiT training by over 17.5$\times$, matching the performance (without classifier-free guidance) of a SiT-XL model trained for 7M steps in less than 400K steps. In terms of final generation quality, our approach achieves state-of-the-art results of FID=1.42 using classifier-free guidance with the guidance interval.

Deep Learning · Generative Models and Autoencoders

Erik Bodin, Alexandru Stere, Dragos Margineantu, Carl Ek, Henry Moss

Sampling from generative models has become a crucial tool for applications like data synthesis and augmentation. Diffusion, Flow Matching and Continuous Normalizing Flows have shown effectiveness across various modalities, and rely on latent variables for generation. For experimental design or creative applications that require more control over the generation process, it has become common to manipulate the latent variable directly. However, existing approaches for performing such manipulations (e.g. interpolation or forming low-dimensional representations) only work well in special cases or are network or data-modality specific. We propose Linear combinations of Latent variables (LOL) as a general-purpose method to form linear combinations of latent variables that adhere to the assumptions of the generative model. As LOL is easy to implement and naturally addresses the broader task of forming any linear combinations, e.g. the construction of subspaces of the latent space, LOL dramatically simplifies the creation of expressive low-dimensional representations of high-dimensional objects.