arXiv subjects

Severi Rissanen

Publications and source records attributed to Severi Rissanen.

9 recordsLinked to original sources

arXiv2026

Softly Constrained Denoisers for Diffusion Models Applied to Partial Differential Equations

Diffusion models have become a powerful generative prior for solutions of partial differential equations (PDEs). Existing approaches enforce physical constraints either by adding the PDE residuals as loss regularizers or through inference-time adjustments. These methods bias the model away from the true data distribution, which is especially problematic when the governing PDE is misspecified. To circumvent these issues while making the most out of the PDE constraint, we introduce soft inductive biases into the denoiser architecture derived from the PDEs. We show that these softly constrained denoisers exploit constraint knowledge to improve compliance over standard denoisers, while maintaining enough flexibility to deviate from it in case of misspecification with respect to observed data.

cs.LG↗

arXiv2026

PriorGuide: Test-Time Prior Adaptation for Simulation-Based Inference

Amortized simulator-based inference offers a powerful framework for tackling Bayesian inference in computational fields such as engineering or neuroscience, increasingly leveraging modern generative methods like diffusion models to map observed data to model parameters or future predictions. These approaches yield posterior or posterior-predictive samples for new datasets without requiring further simulator calls after training on simulated parameter-data pairs. However, their applicability is often limited by the prior distribution(s) used to generate model parameters during this training phase. To overcome this constraint, we introduce PriorGuide, a technique specifically designed for diffusion-based amortized inference methods. PriorGuide leverages a novel guidance approximation that enables flexible adaptation of the trained diffusion model to new priors at test time, crucially without costly retraining. This allows users to readily incorporate updated information or expert knowledge post-training, enhancing the versatility of pre-trained inference models.

stat.ML↗

arXiv2026

Pareto-Conditioned Diffusion Models for Offline Multi-Objective Optimization

Multi-objective optimization (MOO) arises in many real-world applications where trade-offs between competing objectives must be carefully balanced. In the offline setting, where only a static dataset is available, the main challenge is generalizing beyond observed data. We introduce Pareto-Conditioned Diffusion (PCD), a novel framework that formulates offline MOO as a conditional sampling problem. By conditioning directly on desired trade-offs, PCD avoids the need for explicit surrogate models. To effectively explore the Pareto front, PCD employs a reweighting strategy that focuses on high-performing samples and a reference-direction mechanism to guide sampling towards novel, promising regions beyond the training data. Experiments on standard offline MOO benchmarks show that PCD achieves highly competitive performance and, importantly, demonstrates greater consistency across diverse tasks than existing offline MOO approaches.

cs.LG↗

arXiv2025

Progressive Tempering Sampler with Diffusion

Recent research has focused on designing neural samplers that amortize the process of sampling from unnormalized densities. However, despite significant advancements, they still fall short of the state-of-the-art MCMC approach, Parallel Tempering (PT), when it comes to the efficiency of target evaluations. On the other hand, unlike a well-trained neural sampler, PT yields only dependent samples and needs to be rerun -- at considerable computational cost -- whenever new samples are required. To address these weaknesses, we propose the Progressive Tempering Sampler with Diffusion (PTSD), which trains diffusion models sequentially across temperatures, leveraging the advantages of PT to improve the training of neural samplers. We also introduce a novel method to combine high-temperature diffusion models to generate approximate lower-temperature samples, which are minimally refined using MCMC and used to train the next diffusion model. PTSD enables efficient reuse of sample information across temperature levels while generating well-mixed, uncorrelated samples. Our method significantly improves target evaluation efficiency, outperforming diffusion-based neural samplers.

cs.LG↗

arXiv2025

Equivariant Denoisers Cannot Copy Graphs: Align Your Graph Diffusion Models

Graph diffusion models, dominant in graph generative modeling, remain underexplored for graph-to-graph translation tasks like chemical reaction prediction. We demonstrate that standard permutation equivariant denoisers face fundamental limitations in these tasks due to their inability to break symmetries in noisy inputs. To address this, we propose aligning input and target graphs to break input symmetries while preserving permutation equivariance in non-matching graph portions. Using retrosynthesis (i.e., the task of predicting precursors for synthesis of a given target molecule) as our application domain, we show how alignment dramatically improves discrete diffusion model performance from 5% to a SOTA-matching 54.7% top-1 accuracy. Code is available at https://github.com/Aalto-QuML/DiffAlign.

cs.LG↗

arXiv2025

Free Hunch: Denoiser Covariance Estimation for Diffusion Models Without Extra Costs

The covariance for clean data given a noisy observation is an important quantity in many training-free guided generation methods for diffusion models. Current methods require heavy test-time computation, altering the standard diffusion training process or denoiser architecture, or making heavy approximations. We propose a new framework that sidesteps these issues by using covariance information that is available for free from training data and the curvature of the generative trajectory, which is linked to the covariance through the second-order Tweedie's formula. We integrate these sources of information using (i) a novel method to transfer covariance estimates across noise levels and (ii) low-rank updates in a given noise level. We validate the method on linear inverse problems, where it outperforms recent baselines, especially with fewer diffusion steps.

cs.LG↗

arXiv2024

Improving Discrete Diffusion Models via Structured Preferential Generation

In the domains of image and audio, diffusion models have shown impressive performance. However, their application to discrete data types, such as language, has often been suboptimal compared to autoregressive generative models. This paper tackles the challenge of improving discrete diffusion models by introducing a structured forward process that leverages the inherent information hierarchy in discrete categories, such as words in text. Our approach biases the generative process to produce certain categories before others, resulting in a notable improvement in log-likelihood scores on the text8 dataset. This work paves the way for more advances in discrete diffusion models with potentially significant enhancements in performance.

cs.LG↗

arXiv2023

Generative Modelling With Inverse Heat Dissipation

While diffusion models have shown great success in image generation, their noise-inverting generative process does not explicitly consider the structure of images, such as their inherent multi-scale nature. Inspired by diffusion models and the empirical success of coarse-to-fine modelling, we propose a new diffusion-like model that generates images through stochastically reversing the heat equation, a PDE that locally erases fine-scale information when run over the 2D plane of the image. We interpret the solution of the forward heat equation with constant additive noise as a variational approximation in the diffusion latent variable model. Our new model shows emergent qualitative properties not seen in standard diffusion models, such as disentanglement of overall colour and shape in images. Spectral analysis on natural images highlights connections to diffusion models and reveals an implicit coarse-to-fine inductive bias in them.

cs.CV↗

arXiv2022

A Critical Look at the Consistency of Causal Estimation With Deep Latent Variable Models

Using deep latent variable models in causal inference has attracted considerable interest recently, but an essential open question is their ability to yield consistent causal estimates. While they have demonstrated promising results and theory exists on some simple model formulations, we also know that causal effects are not even identifiable in general with latent variables. We investigate this gap between theory and empirical results with analytical considerations and extensive experiments under multiple synthetic and real-world data sets, using the causal effect variational autoencoder (CEVAE) as a case study. While CEVAE seems to work reliably under some simple scenarios, it does not estimate the causal effect correctly with a misspecified latent variable or a complex data distribution, as opposed to its original motivation. Hence, our results show that more attention should be paid to ensuring the correctness of causal estimates with deep latent variable models.

cs.LG↗