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Yaron Lipman

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33 papers
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33

NeurIPS Conference 2025 Conference Paper

Corrector Sampling in Language Models

  • Itai Gat
  • Neta Shaul
  • Uriel Singer
  • Yaron Lipman

Autoregressive language models accumulate errors due to their fixed, irrevocable left-to-right token generation. To address this, we propose a new sampling method called Resample-Previous-Tokens (RPT). RPT mitigates error accumulation by iteratively revisiting and potentially replacing tokens in a window of previously generated text. Fine-tuning a pretrained 8B parameter model with RPT for only 100B resulted in ~10% relative improvements on reasoning and coding benchmarks compared to the standard sampling.

ICLR Conference 2025 Conference Paper

Flow Matching with General Discrete Paths: A Kinetic-Optimal Perspective

  • Neta Shaul
  • Itai Gat
  • Marton Havasi
  • Daniel Severo 0001
  • Anuroop Sriram
  • Peter Holderrieth
  • Brian Karrer
  • Yaron Lipman

The design space of discrete-space diffusion or flow generative models are significantly less well-understood than their continuous-space counterparts, with many works focusing only on a simple masked construction. In this work, we aim to take a holistic approach to the construction of discrete generative models based on continuous-time Markov chains, and for the first time, allow the use of arbitrary discrete probability paths, or colloquially, corruption processes. Through the lens of optimizing the symmetric kinetic energy, we propose velocity formulas that can be applied to any given probability path, completely decoupling the probability and velocity, and giving the user the freedom to specify any desirable probability path based on expert knowledge specific to the data domain. Furthermore, we find that a special construction of mixture probability paths optimizes the symmetric kinetic energy for the discrete case. We empirically validate the usefulness of this new design space across multiple modalities: text generation, inorganic material generation, and image generation. We find that we can outperform the mask construction even in text with kinetic-optimal mixture paths, while we can make use of domain-specific constructions of the probability path over the visual domain.

ICLR Conference 2025 Conference Paper

Generator Matching: Generative modeling with arbitrary Markov processes

  • Peter Holderrieth
  • Marton Havasi
  • Jason Yim
  • Neta Shaul
  • Itai Gat
  • Tommi S. Jaakkola
  • Brian Karrer
  • Ricky T. Q. Chen

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.

NeurIPS Conference 2025 Conference Paper

Transition Matching: Scalable and Flexible Generative Modeling

  • Neta Shaul
  • Uriel Singer
  • Itai Gat
  • Yaron Lipman

Diffusion and flow matching models have significantly advanced media generation, yet their design space is well-explored, somewhat limiting further improvements. Concurrently, autoregressive (AR) models, particularly those generating continuous tokens, have emerged as a promising direction for unifying text and media generation, showing improved performance at scale. This paper introduces Transition Matching (TM), a novel discrete-time, continuous-state generative paradigm that unifies and advances both diffusion/flow models and continuous AR generation. TM decomposes complex generation tasks into simpler Markov transitions, allowing for expressive non-deterministic probability transition kernels and arbitrary non-continuous supervision processes, thereby unlocking new flexible design avenues. We explore these choices through three TM variants: (i) Difference Transition Matching (DTM), which generalizes flow matching to discrete-time by directly learning transition probabilities, yielding state-of-the-art image quality and text adherence. (ii) Autoregressive Transition Matching (ARTM) and (iii) Full History Transition Matching (FHTM) are partially and fully causal models, respectively, that generalize continuous AR methods. They achieve continuous causal AR generation quality comparable to non-causal approaches and potentially enable seamless integration with existing AR text generation techniques. Notably, FHTM is the first fully causal model to match or surpass the performance of flow-based methods on text-to-image task in continuous domains. We demonstrate these contributions through a rigorous large-scale comparison of TM variants and relevant baselines, maintaining a fixed architecture, training data, and hyperparameters.

ICML Conference 2024 Conference Paper

Bespoke Non-Stationary Solvers for Fast Sampling of Diffusion and Flow Models

  • Neta Shaul
  • Uriel Singer
  • Ricky T. Q. Chen
  • Matthew Le 0001
  • Ali K. Thabet
  • Albert Pumarola
  • Yaron Lipman

This paper introduces Bespoke Non-Stationary (BNS) Solvers, a solver distillation approach to improve sample efficiency of Diffusion and Flow models. BNS solvers are based on a family of non-stationary solvers that provably subsumes existing numerical ODE solvers and consequently demonstrate considerable improvement in sample approximation (PSNR) over these baselines. Compared to model distillation, BNS solvers benefit from a tiny parameter space ($<$200 parameters), fast optimization (two orders of magnitude faster), maintain diversity of samples, and in contrast to previous solver distillation approaches nearly close the gap from standard distillation methods such as Progressive Distillation in the low-medium NFE regime. For example, BNS solver achieves 45 PSNR / 1. 76 FID using 16 NFE in class-conditional ImageNet-64. We experimented with BNS solvers for conditional image generation, text-to-image generation, and text-2-audio generation showing significant improvement in sample approximation (PSNR) in all.

ICLR Conference 2024 Conference Paper

Bespoke Solvers for Generative Flow Models

  • Neta Shaul
  • Juan Camilo Pérez
  • Ricky T. Q. Chen
  • Ali K. Thabet
  • Albert Pumarola
  • Yaron Lipman

Diffusion or flow-based models are powerful generative paradigms that are notoriously hard to sample as samples are defined as solutions to high-dimensional Ordinary or Stochastic Differential Equations (ODEs/SDEs) which require a large Number of Function Evaluations (NFE) to approximate well. Existing methods to alleviate the costly sampling process include model distillation and designing dedicated ODE solvers. However, distillation is costly to train and sometimes can deteriorate quality, while dedicated solvers still require relatively large NFE to produce high quality samples. In this paper we introduce ``Bespoke solvers'', a novel framework for constructing custom ODE solvers tailored to the ODE of a given pre-trained flow model. Our approach optimizes an order consistent and parameter-efficient solver (e.g., with 80 learnable parameters), is trained for roughly 1\% of the GPU time required for training the pre-trained model, and significantly improves approximation and generation quality compared to dedicated solvers. For example, a Bespoke solver for a CIFAR10 model produces samples with Fréchet Inception Distance (FID) of 2.73 with 10 NFE, and gets to 1\% of the Ground Truth (GT) FID (2.59) for this model with only 20 NFE. On the more challenging ImageNet-64$\times$64, Bespoke samples at 2.2 FID with 10 NFE, and gets within 2\% of GT FID (1.71) with 20 NFE.

ICML Conference 2024 Conference Paper

D-Flow: Differentiating through Flows for Controlled Generation

  • Heli Ben-Hamu
  • Omri Puny
  • Itai Gat
  • Brian Karrer
  • Uriel Singer
  • Yaron Lipman

Taming the generation outcome of state of the art Diffusion and Flow-Matching (FM) models without having to re-train a task-specific model unlocks a powerful tool for solving inverse problems, conditional generation, and controlled generation in general. In this work we introduce D-Flow, a simple framework for controlling the generation process by differentiating through the flow, optimizing for the source (noise) point. We motivate this framework by our key observation stating that for Diffusion/FM models trained with Gaussian probability paths, differentiating through the generation process projects gradient on the data manifold, implicitly injecting the prior into the optimization process. We validate our framework on linear and non-linear controlled generation problems including: image and audio inverse problems and conditional molecule generation reaching state of the art performance across all.

NeurIPS Conference 2024 Conference Paper

Discrete Flow Matching

  • Itai Gat
  • Tal Remez
  • Neta Shaul
  • Felix Kreuk
  • Ricky T. Q. Chen
  • Gabriel Synnaeve
  • Yossi Adi
  • Yaron Lipman

Despite Flow Matching and diffusion models having emerged as powerful generative paradigms for continuous variables such as images and videos, their application to high-dimensional discrete data, such as language, is still limited. In this work, we present Discrete Flow Matching, a novel discrete flow paradigm designed specifically for generating discrete data. Discrete Flow Matching offers several key contributions: (i) it works with a general family of probability paths interpolating between source and target distributions; (ii) it allows for a generic formula for sampling from these probability paths using learned posteriors such as the probability denoiser ($x$-prediction) and noise-prediction ($\epsilon$-prediction); (iii) practically, focusing on specific probability paths defined with different schedulers improves generative perplexity compared to previous discrete diffusion and flow models; and (iv) by scaling Discrete Flow Matching models up to 1. 7B parameters, we reach 6. 7% Pass@1 and 13. 4% Pass@10 on HumanEval and 6. 7% Pass@1 and 20. 6% Pass@10 on 1-shot MBPP coding benchmarks. Our approach is capable of generating high-quality discrete data in a non-autoregressive fashion, significantly closing the gap between autoregressive models and discrete flow models.

ICLR Conference 2024 Conference Paper

Flow Matching on General Geometries

  • Ricky T. Q. Chen
  • Yaron Lipman

We propose Riemannian Flow Matching (RFM), a simple yet powerful framework for training continuous normalizing flows on manifolds. Existing methods for generative modeling on manifolds either require expensive simulation, are inherently unable to scale to high dimensions, or use approximations for limiting quantities that result in biased training objectives. Riemannian Flow Matching bypasses these limitations and offers several advantages over previous approaches: it is simulation-free on simple geometries, does not require divergence computation, and computes its target vector field in closed-form. The key ingredient behind RFM is the construction of a relatively simple premetric for defining target vector fields, which encompasses the existing Euclidean case. To extend to general geometries, we rely on the use of spectral decompositions to efficiently compute premetrics on the fly. Our method achieves state-of-the-art performance on real-world non-Euclidean datasets, and we demonstrate tractable training on general geometries, including triangular meshes with highly non-trivial curvature and boundaries.

ICLR Conference 2024 Conference Paper

Generalized Schrödinger Bridge Matching

  • Guan-Horng Liu
  • Yaron Lipman
  • Maximilian Nickel
  • Brian Karrer
  • Evangelos A. Theodorou
  • Ricky T. Q. Chen

Modern distribution matching algorithms for training diffusion or flow models directly prescribe the time evolution of the marginal distributions between two boundary distributions. In this work, we consider a generalized distribution matching setup, where these marginals are only implicitly described as a solution to some task-specific objective function. The problem setup, known as the Generalized Schrödinger Bridge (GSB), appears prevalently in many scientific areas both within and without machine learning. We propose Generalized Schödinger Bridge Matching (GSBM), a new matching algorithm inspired by recent advances, generalizing them beyond kinetic energy minimization and to account for nonlinear state costs. We show that such a generalization can be cast as solving conditional stochastic optimal control, for which efficient variational approximations can be used, and further debiased with the aid of path integral theory. Compared to prior methods for solving GSB problems, our GSBM algorithm always preserves a feasible transport map between the boundary distributions throughout training, thereby enabling stable convergence and significantly improved scalability. We empirically validate our claims on an extensive suite of experimental setups, including crowd navigation, opinion depolarization, LiDAR manifolds, and image domain transfer. Our work brings new algorithmic opportunities for training diffusion models enhanced with task-specific optimality structures.

ICML Conference 2023 Conference Paper

Equivariant Polynomials for Graph Neural Networks

  • Omri Puny
  • Derek Lim
  • Bobak Toussi Kiani
  • Haggai Maron
  • Yaron Lipman

Graph Neural Networks (GNN) are inherently limited in their expressive power. Recent seminal works (Xu et al. , 2019; Morris et al. , 2019b) introduced the Weisfeiler-Lehman (WL) hierarchy as a measure of expressive power. Although this hierarchy has propelled significant advances in GNN analysis and architecture developments, it suffers from several significant limitations. These include a complex definition that lacks direct guidance for model improvement and a WL hierarchy that is too coarse to study current GNNs. This paper introduces an alternative expressive power hierarchy based on the ability of GNNs to calculate equivariant polynomials of a certain degree. As a first step, we provide a full characterization of all equivariant graph polynomials by introducing a concrete basis, significantly generalizing previous results. Each basis element corresponds to a specific multi-graph, and its computation over some graph data input corresponds to a tensor contraction problem. Second, we propose algorithmic tools for evaluating the expressiveness of GNNs using tensor contraction sequences, and calculate the expressive power of popular GNNs. Finally, we enhance the expressivity of common GNN architectures by adding polynomial features or additional operations / aggregations inspired by our theory. These enhanced GNNs demonstrate state-of-the-art results in experiments across multiple graph learning benchmarks.

ICLR Conference 2023 Conference Paper

Flow Matching for Generative Modeling

  • Yaron Lipman
  • Ricky T. Q. Chen
  • Heli Ben-Hamu
  • Maximilian Nickel
  • Matthew Le 0001

We introduce a new paradigm for generative modeling built on Continuous Normalizing Flows (CNFs), allowing us to train CNFs at unprecedented scale. Specifically, we present the notion of Flow Matching (FM), a simulation-free approach for training CNFs based on regressing vector fields of fixed conditional probability paths. Flow Matching is compatible with a general family of Gaussian probability paths for transforming between noise and data samples---which subsumes existing diffusion paths as specific instances. Interestingly, we find that employing FM with diffusion paths results in a more robust and stable alternative for training diffusion models. Furthermore, Flow Matching opens the door to training CNFs with other, non-diffusion probability paths. An instance of particular interest is using Optimal Transport (OT) displacement interpolation to define the conditional probability paths. These paths are more efficient than diffusion paths, provide faster training and sampling, and result in better generalization. Training CNFs using Flow Matching on ImageNet leads to consistently better performance than alternative diffusion-based methods in terms of both likelihood and sample quality, and allows fast and reliable sample generation using off-the-shelf numerical ODE solvers.

ICML Conference 2023 Conference Paper

MultiDiffusion: Fusing Diffusion Paths for Controlled Image Generation

  • Omer Bar-Tal
  • Lior Yariv
  • Yaron Lipman
  • Tali Dekel

Recent advances in text-to-image generation with diffusion models present transformative capabilities in image quality. However, user controllability of the generated image, and fast adaptation to new tasks still remains an open challenge, currently mostly addressed by costly and long re-training and fine-tuning or ad-hoc adaptations to specific image generation tasks. In this work, we present MultiDiffusion, a unified framework that enables versatile and controllable image generation, using a pre-trained text-to-image diffusion model, without any further training or finetuning. At the center of our approach is a new generation process, based on an optimization task that binds together multiple diffusion generation processes with a shared set of parameters or constraints. We show that MultiDiffusion can be readily applied to generate high quality and diverse images that adhere to user-provided controls, such as desired aspect ratio (e. g. , panorama), and spatial guiding signals, ranging from tight segmentation masks to bounding boxes.

ICML Conference 2023 Conference Paper

Multisample Flow Matching: Straightening Flows with Minibatch Couplings

  • Aram-Alexandre Pooladian
  • Heli Ben-Hamu
  • Carles Domingo-Enrich
  • Brandon Amos
  • Yaron Lipman
  • Ricky T. Q. Chen

Simulation-free methods for training continuous-time generative models construct probability paths that go between noise distributions and individual data samples. Recent works, such as Flow Matching, derived paths that are optimal for each data sample. However, these algorithms rely on independent data and noise samples, and do not exploit underlying structure in the data distribution for constructing probability paths. We propose Multisample Flow Matching, a more general framework that uses non-trivial couplings between data and noise samples while satisfying the correct marginal constraints. At small overhead costs, this generalization allows us to (i) reduce gradient variance during training, (ii) obtain straighter flows for the learned vector field, which allows us to generate high-quality samples using fewer function evaluations, and (iii) obtain transport maps with low cost in high dimensions, which has applications beyond generative modeling. Importantly, we do so in a completely simulation-free manner with a simple minimization objective. We show that our proposed methods improve sample consistency on downsampled ImageNet data sets, and lead to better low-cost sample generation.

ICML Conference 2023 Conference Paper

On Kinetic Optimal Probability Paths for Generative Models

  • Neta Shaul
  • Ricky T. Q. Chen
  • Maximilian Nickel
  • Matthew Le 0001
  • Yaron Lipman

Recent successful generative models are trained by fitting a neural network to an a-priori defined tractable probability density path taking noise to training examples. In this paper we investigate the space of Gaussian probability paths, which includes diffusion paths as an instance, and look for an optimal member in some useful sense. In particular, minimizing the Kinetic Energy (KE) of a path is known to make particles’ trajectories simple, hence easier to sample, and empirically improve performance in terms of likelihood of unseen data and sample generation quality. We investigate Kinetic Optimal (KO) Gaussian paths and offer the following observations: (i) We show the KE takes a simplified form on the space of Gaussian paths, where the data is incorporated only through a single, one dimensional scalar function, called the data separation function. (ii) We characterize the KO solutions with a one dimensional ODE. (iii) We approximate data-dependent KO paths by approximating the data separation function and minimizing the KE. (iv) We prove that the data separation function converges to $1$ in the general case of arbitrary normalized dataset consisting of $n$ samples in $d$ dimension as $n/\sqrt{d}\rightarrow 0$. A consequence of this result is that the Conditional Optimal Transport (Cond-OT) path becomes kinetic optimal as $n/\sqrt{d}\rightarrow 0$. We further support this theory with empirical experiments on ImageNet.

JMLR Journal 2023 Journal Article

Weisfeiler and Leman go Machine Learning: The Story so far

  • Christopher Morris
  • Yaron Lipman
  • Haggai Maron
  • Bastian Rieck
  • Nils M. Kriege
  • Martin Grohe
  • Matthias Fey
  • Karsten Borgwardt

In recent years, algorithms and neural architectures based on the Weisfeiler–Leman algorithm, a well-known heuristic for the graph isomorphism problem, have emerged as a powerful tool for machine learning with graphs and relational data. Here, we give a comprehensive overview of the algorithm’s use in a machine-learning setting, focusing on the supervised regime. We discuss the theoretical background, show how to use it for supervised graph and node representation learning, discuss recent extensions, and outline the algorithm’s connection to (permutation-)equivariant neural architectures. Moreover, we give an overview of current applications and future directions to stimulate further research. [abs] [ pdf ][ bib ] &copy JMLR 2023. ( edit, beta )

ICLR Conference 2022 Conference Paper

Frame Averaging for Invariant and Equivariant Network Design

  • Omri Puny
  • Matan Atzmon
  • Edward J. Smith
  • Ishan Misra
  • Aditya Grover
  • Heli Ben-Hamu
  • Yaron Lipman

Many machine learning tasks involve learning functions that are known to be invariant or equivariant to certain symmetries of the input data. However, it is often challenging to design neural network architectures that respect these symmetries while being expressive and computationally efficient. For example, Euclidean motion invariant/equivariant graph or point cloud neural networks. We introduce Frame Averaging (FA), a highly general purpose and systematic framework for adapting known (backbone) architectures to become invariant or equivariant to new symmetry types. Our framework builds on the well known group averaging operator that guarantees invariance or equivariance but is intractable. In contrast, we observe that for many important classes of symmetries, this operator can be replaced with an averaging operator over a small subset of the group elements, called a frame. We show that averaging over a frame guarantees exact invariance or equivariance while often being much simpler to compute than averaging over the entire group. Furthermore, we prove that FA-based models have maximal expressive power in a broad setting and in general preserve the expressive power of their backbone architectures. Using frame averaging, we propose a new class of universal Graph Neural Networks (GNNs), universal Euclidean motion invariant point cloud networks, and Euclidean motion invariant Message Passing (MP) GNNs. We demonstrate the practical effectiveness of FA on several applications including point cloud normal estimation, beyond $2$-WL graph separation, and $n$-body dynamics prediction, achieving state-of-the-art results in all of these benchmarks.

ICML Conference 2022 Conference Paper

Matching Normalizing Flows and Probability Paths on Manifolds

  • Heli Ben-Hamu
  • Samuel Cohen
  • Avishek Joey Bose
  • Brandon Amos
  • Maximilian Nickel
  • Aditya Grover
  • Ricky T. Q. Chen
  • Yaron Lipman

Continuous Normalizing Flows (CNFs) are a class of generative models that transform a prior distribution to a model distribution by solving an ordinary differential equation (ODE). We propose to train CNFs on manifolds by minimizing probability path divergence (PPD), a novel family of divergences between the probability density path generated by the CNF and a target probability density path. PPD is formulated using a logarithmic mass conservation formula which is a linear first order partial differential equation relating the log target probabilities and the CNF’s defining vector field. PPD has several key benefits over existing methods: it sidesteps the need to solve an ODE per iteration, readily applies to manifold data, scales to high dimensions, and is compatible with a large family of target paths interpolating pure noise and data in finite time. Theoretically, PPD is shown to bound classical probability divergences. Empirically, we show that CNFs learned by minimizing PPD achieve state-of-the-art results in likelihoods and sample quality on existing low-dimensional manifold benchmarks, and is the first example of a generative model to scale to moderately high dimensional manifolds.

NeurIPS Conference 2022 Conference Paper

Neural Conservation Laws: A Divergence-Free Perspective

  • Jack Richter-Powell
  • Yaron Lipman
  • Ricky T. Q. Chen

We investigate the parameterization of deep neural networks that by design satisfy the continuity equation, a fundamental conservation law. This is enabled by the observation that any solution of the continuity equation can be represented as a divergence-free vector field. We hence propose building divergence-free neural networks through the concept of differential forms, and with the aid of automatic differentiation, realize two practical constructions. As a result, we can parameterize pairs of densities and vector fields that always satisfy the continuity equation by construction, foregoing the need for extra penalty methods or expensive numerical simulation. Furthermore, we prove these models are universal and so can be used to represent any divergence-free vector field. Finally, we experimentally validate our approaches by computing neural network-based solutions to fluid equations, solving for the Hodge decomposition, and learning dynamical optimal transport maps.

NeurIPS Conference 2022 Conference Paper

VisCo Grids: Surface Reconstruction with Viscosity and Coarea Grids

  • Albert Pumarola
  • Artsiom Sanakoyeu
  • Lior Yariv
  • Ali Thabet
  • Yaron Lipman

Surface reconstruction has been seeing a lot of progress lately by utilizing Implicit Neural Representations (INRs). Despite their success, INRs often introduce hard to control inductive bias (i. e. , the solution surface can exhibit unexplainable behaviours), have costly inference, and are slow to train. The goal of this work is to show that replacing neural networks with simple grid functions, along with two novel geometric priors achieve comparable results to INRs, with instant inference, and improved training times. To that end we introduce VisCo Grids: a grid-based surface reconstruction method incorporating Viscosity and Coarea priors. Intuitively, the Viscosity prior replaces the smoothness inductive bias of INRs, while the Coarea favors a minimal area solution. Experimenting with VisCo Grids on a standard reconstruction baseline provided comparable results to the best performing INRs on this dataset.

NeurIPS Conference 2021 Conference Paper

Moser Flow: Divergence-based Generative Modeling on Manifolds

  • Noam Rozen
  • Aditya Grover
  • Maximilian Nickel
  • Yaron Lipman

We are interested in learning generative models for complex geometries described via manifolds, such as spheres, tori, and other implicit surfaces. Current extensions of existing (Euclidean) generative models are restricted to specific geometries and typically suffer from high computational costs. We introduce Moser Flow (MF), a new class of generative models within the family of continuous normalizing flows (CNF). MF also produces a CNF via a solution to the change-of-variable formula, however differently from other CNF methods, its model (learned) density is parameterized as the source (prior) density minus the divergence of a neural network (NN). The divergence is a local, linear differential operator, easy to approximate and calculate on manifolds. Therefore, unlike other CNFs, MF does not require invoking or backpropagating through an ODE solver during training. Furthermore, representing the model density explicitly as the divergence of a NN rather than as a solution of an ODE facilitates learning high fidelity densities. Theoretically, we prove that MF constitutes a universal density approximator under suitable assumptions. Empirically, we demonstrate for the first time the use of flow models for sampling from general curved surfaces and achieve significant improvements in density estimation, sample quality, and training complexity over existing CNFs on challenging synthetic geometries and real-world benchmarks from the earth and climate sciences.

ICML Conference 2021 Conference Paper

Phase Transitions, Distance Functions, and Implicit Neural Representations

  • Yaron Lipman

Representing surfaces as zero level sets of neural networks recently emerged as a powerful modeling paradigm, named Implicit Neural Representations (INRs), serving numerous downstream applications in geometric deep learning and 3D vision. Training INRs previously required choosing between occupancy and distance function representation and different losses with unknown limit behavior and/or bias. In this paper we draw inspiration from the theory of phase transitions of fluids and suggest a loss for training INRs that learns a density function that converges to a proper occupancy function, while its log transform converges to a distance function. Furthermore, we analyze the limit minimizer of this loss showing it satisfies the reconstruction constraints and has minimal surface perimeter, a desirable inductive bias for surface reconstruction. Training INRs with this new loss leads to state-of-the-art reconstructions on a standard benchmark.

ICML Conference 2021 Conference Paper

Riemannian Convex Potential Maps

  • Samuel Cohen
  • Brandon Amos
  • Yaron Lipman

Modeling distributions on Riemannian manifolds is a crucial component in understanding non-Euclidean data that arises, e. g. , in physics and geology. The budding approaches in this space are limited by representational and computational tradeoffs. We propose and study a class of flows that uses convex potentials from Riemannian optimal transport. These are universal and can model distributions on any compact Riemannian manifold without requiring domain knowledge of the manifold to be integrated into the architecture. We demonstrate that these flows can model standard distributions on spheres, and tori, on synthetic and geological data.

ICLR Conference 2021 Conference Paper

SALD: Sign Agnostic Learning with Derivatives

  • Matan Atzmon
  • Yaron Lipman

Learning 3D geometry directly from raw data, such as point clouds, triangle soups, or unoriented meshes is still a challenging task that feeds many downstream computer vision and graphics applications. In this paper, we introduce SALD: a method for learning implicit neural representations of shapes directly from raw data. We generalize sign agnostic learning (SAL) to include derivatives: given an unsigned distance function to the input raw data, we advocate a novel sign agnostic regression loss, incorporating both pointwise values and gradients of the unsigned distance function. Optimizing this loss leads to a signed implicit function solution, the zero level set of which is a high quality and valid manifold approximation to the input 3D data. The motivation behind SALD is that incorporating derivatives in a regression loss leads to a lower sample complexity, and consequently better fitting. In addition, we provide empirical evidence, as well as theoretical motivation in 2D that SAL enjoys a minimal surface property, favoring minimal area solutions. More importantly, we are able to show that this property still holds for SALD, i.e., with derivatives included. We demonstrate the efficacy of SALD for shape space learning on two challenging datasets: ShapeNet that contains inconsistent orientation and non-manifold meshes, and D-Faust that contains raw 3D scans (triangle soups). On both these datasets, we present state-of-the-art results.

NeurIPS Conference 2021 Conference Paper

Volume Rendering of Neural Implicit Surfaces

  • Lior Yariv
  • Jiatao Gu
  • Yoni Kasten
  • Yaron Lipman

Neural volume rendering became increasingly popular recently due to its success in synthesizing novel views of a scene from a sparse set of input images. So far, the geometry learned by neural volume rendering techniques was modeled using a generic density function. Furthermore, the geometry itself was extracted using an arbitrary level set of the density function leading to a noisy, often low fidelity reconstruction. The goal of this paper is to improve geometry representation and reconstruction in neural volume rendering. We achieve that by modeling the volume density as a function of the geometry. This is in contrast to previous work modeling the geometry as a function of the volume density. In more detail, we define the volume density function as Laplace's cumulative distribution function (CDF) applied to a signed distance function (SDF) representation. This simple density representation has three benefits: (i) it provides a useful inductive bias to the geometry learned in the neural volume rendering process; (ii) it facilitates a bound on the opacity approximation error, leading to an accurate sampling of the viewing ray. Accurate sampling is important to provide a precise coupling of geometry and radiance; and (iii) it allows efficient unsupervised disentanglement of shape and appearance in volume rendering. Applying this new density representation to challenging scene multiview datasets produced high quality geometry reconstructions, outperforming relevant baselines. Furthermore, switching shape and appearance between scenes is possible due to the disentanglement of the two.

ICML Conference 2020 Conference Paper

Implicit Geometric Regularization for Learning Shapes

  • Amos Gropp
  • Lior Yariv
  • Niv Haim
  • Matan Atzmon
  • Yaron Lipman

Representing shapes as level-sets of neural networks has been recently proved to be useful for different shape analysis and reconstruction tasks. So far, such representations were computed using either: (i) pre-computed implicit shape representations; or (ii) loss functions explicitly defined over the neural level-sets. In this paper we offer a new paradigm for computing high fidelity implicit neural representations directly from raw data (i. e. , point clouds, with or without normal information). We observe that a rather simple loss function, encouraging the neural network to vanish on the input point cloud and to have a unit norm gradient, possesses an implicit geometric regularization property that favors smooth and natural zero level-set surfaces, avoiding bad zero-loss solutions. We provide a theoretical analysis of this property for the linear case, and show that, in practice, our method leads to state-of-the-art implicit neural representations with higher level-of-details and fidelity compared to previous methods.

NeurIPS Conference 2020 Conference Paper

Multiview Neural Surface Reconstruction by Disentangling Geometry and Appearance

  • Lior Yariv
  • Yoni Kasten
  • Dror Moran
  • Meirav Galun
  • Matan Atzmon
  • Basri Ronen
  • Yaron Lipman

In this work we address the challenging problem of multiview 3D surface reconstruction. We introduce a neural network architecture that simultaneously learns the unknown geometry, camera parameters, and a neural renderer that approximates the light reflected from the surface towards the camera. The geometry is represented as a zero level-set of a neural network, while the neural renderer, derived from the rendering equation, is capable of (implicitly) modeling a wide set of lighting conditions and materials. We trained our network on real world 2D images of objects with different material properties, lighting conditions, and noisy camera initializations from the DTU MVS dataset. We found our model to produce state of the art 3D surface reconstructions with high fidelity, resolution and detail.

ICLR Conference 2020 Conference Paper

On Universal Equivariant Set Networks

  • Nimrod Segol
  • Yaron Lipman

Using deep neural networks that are either invariant or equivariant to permutations in order to learn functions on unordered sets has become prevalent. The most popular, basic models are DeepSets (Zaheer et al. 2017) and PointNet (Qi et al. 2017). While known to be universal for approximating invariant functions, DeepSets and PointNet are not known to be universal when approximating equivariant set functions. On the other hand, several recent equivariant set architectures have been proven equivariant universal (Sannai et al. 2019, Keriven and Peyre 2019), however these models either use layers that are not permutation equivariant (in the standard sense) and/or use higher order tensor variables which are less practical. There is, therefore, a gap in understanding the universality of popular equivariant set models versus theoretical ones. In this paper we close this gap by proving that: (i) PointNet is not equivariant universal; and (ii) adding a single linear transmission layer makes PointNet universal. We call this architecture PointNetST and argue it is the simplest permutation equivariant universal model known to date. Another consequence is that DeepSets is universal, and also PointNetSeg, a popular point cloud segmentation network (used e.g., in Qi et al. 2017) is universal. The key theoretical tool used to prove the above results is an explicit characterization of all permutation equivariant polynomial layers. Lastly, we provide numerical experiments validating the theoretical results and comparing different permutation equivariant models.

NeurIPS Conference 2020 Conference Paper

Set2Graph: Learning Graphs From Sets

  • Hadar Serviansky
  • Nimrod Segol
  • Jonathan Shlomi
  • Kyle Cranmer
  • Eilam Gross
  • Haggai Maron
  • Yaron Lipman

Many problems in machine learning (ML) can be cast as learning functions from sets to graphs, or more generally to hypergraphs; in short, Set2Graph functions. Examples include clustering, learning vertex and edge features on graphs, and learning features on triplets in a collection. A natural approach for building Set2Graph models is to characterize all linear equivariant set-to-hypergraph layers and stack them with non-linear activations. This posses two challenges: (i) the expressive power of these networks is not well understood; and (ii) these models would suffer from high, often intractable computational and memory complexity, as their dimension grows exponentially. This paper advocates a family of neural network models for learning Set2Graph functions that is both practical and of maximal expressive power (universal), that is, can approximate arbitrary continuous Set2Graph functions over compact sets. Testing these models on different machine learning tasks, mainly an application to particle physics, we find them favorable to existing baselines.

NeurIPS Conference 2019 Conference Paper

Controlling Neural Level Sets

  • Matan Atzmon
  • Niv Haim
  • Lior Yariv
  • Ofer Israelov
  • Haggai Maron
  • Yaron Lipman

The level sets of neural networks represent fundamental properties such as decision boundaries of classifiers and are used to model non-linear manifold data such as curves and surfaces. Thus, methods for controlling the neural level sets could find many applications in machine learning. In this paper we present a simple and scalable approach to directly control level sets of a deep neural network. Our method consists of two parts: (i) sampling of the neural level sets, and (ii) relating the samples' positions to the network parameters. The latter is achieved by a sample network that is constructed by adding a single fixed linear layer to the original network. In turn, the sample network can be used to incorporate the level set samples into a loss function of interest. We have tested our method on three different learning tasks: improving generalization to unseen data, training networks robust to adversarial attacks, and curve and surface reconstruction from point clouds. For surface reconstruction, we produce high fidelity surfaces directly from raw 3D point clouds. When training small to medium networks to be robust to adversarial attacks we obtain robust accuracy comparable to state-of-the-art methods.

ICML Conference 2019 Conference Paper

On the Universality of Invariant Networks

  • Haggai Maron
  • Ethan Fetaya
  • Nimrod Segol
  • Yaron Lipman

Constraining linear layers in neural networks to respect symmetry transformations from a group $G$ is a common design principle for invariant networks that has found many applications in machine learning. In this paper, we consider a fundamental question that has received very little attention to date: Can these networks approximate any (continuous) invariant function? We tackle the rather general case where $G\leq S_n$ (an arbitrary subgroup of the symmetric group) that acts on $\R^n$ by permuting coordinates. This setting includes several recent popular invariant networks. We present two main results: First, $G$-invariant networks are universal if high-order tensors are allowed. Second, there are groups $G$ for which higher-order tensors are unavoidable for obtaining universality. $G$-invariant networks consisting of only first-order tensors are of special interest due to their practical value. We conclude the paper by proving a necessary condition for the universality of $G$-invariant networks that incorporate only first-order tensors. Lastly, we propose a conjecture stating that this condition is also sufficient.

NeurIPS Conference 2019 Conference Paper

Provably Powerful Graph Networks

  • Haggai Maron
  • Heli Ben-Hamu
  • Hadar Serviansky
  • Yaron Lipman

Recently, the Weisfeiler-Lehman (WL) graph isomorphism test was used to measure the expressive power of graph neural networks (GNN). It was shown that the popular message passing GNN cannot distinguish between graphs that are indistinguishable by the $1$-WL test \citep{morris2019, xu2019}. Unfortunately, many simple instances of graphs are indistinguishable by the $1$-WL test. In search for more expressive graph learning models we build upon the recent $k$-order invariant and equivariant graph neural networks \citep{maron2019} and present two results: First, we show that such $k$-order networks can distinguish between non-isomorphic graphs as good as the $k$-WL tests, which are provably stronger than the $1$-WL test for $k>2$. This makes these models strictly stronger than message passing models. Unfortunately, the higher expressiveness of these models comes with a computational cost of processing high order tensors. Second, setting our goal at building a provably stronger, \emph{simple} and \emph{scalable} model we show that a reduced $2$-order network containing just scaled identity operator, augmented with a single quadratic operation (matrix multiplication) has a provable $3$-WL expressive power. Differently put, we suggest a simple model that interleaves applications of standard Multilayer-Perceptron (MLP) applied to the feature dimension and matrix multiplication. We validate this model by presenting state of the art results on popular graph classification and regression tasks. To the best of our knowledge, this is the first practical invariant/equivariant model with guaranteed $3$-WL expressiveness, strictly stronger than message passing models.

NeurIPS Conference 2018 Conference Paper

(Probably) Concave Graph Matching

  • Haggai Maron
  • Yaron Lipman

In this paper we address the graph matching problem. Following the recent works of \cite{zaslavskiy2009path, Vestner2017} we analyze and generalize the idea of concave relaxations. We introduce the concepts of \emph{conditionally concave} and \emph{probably conditionally concave} energies on polytopes and show that they encapsulate many instances of the graph matching problem, including matching Euclidean graphs and graphs on surfaces. We further prove that local minima of probably conditionally concave energies on general matching polytopes (\eg, doubly stochastic) are with high probability extreme points of the matching polytope (\eg, permutations).

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