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Sergei Kholkin

Publications and source records attributed to Sergei Kholkin.

8 recordsLinked to original sources

Impute-EM: Native Mixed-State Diffusion Models for Heterogeneous Data Imputation

Missing values are ubiquitous in heterogeneous data mining, where numerical, categorical, and binary variables often coexist. Many imputation methods, especially diffusion-based ones, treat discrete variables through continuous surrogates such as one-hot relaxations rather than modeling them natively. This creates a mismatch between the model state space and the mixed discrete and continuous structure of the data. We propose Impute-EM, an Expectation Maximization style framework that alternates between imputing missing entries with the current model and refitting a diffusion backbone on completed data. We instantiate Impute-EM with native mixed-state diffusion backbones for heterogeneous data, combining Gaussian and masked categorical components without one-hot relaxations. In exact settings, we characterize the update and show that the observed mask-indexed marginals match the targets at the limit, while making explicit that the full data distribution is generally non-identifiable from incomplete observations alone. Empirically, Impute-EM delivers the best distributional fidelity on mixed-type tabular imputation, on which downstream modeling relies, with text imputation serving as a controlled validation of the native discrete backbone.

cs.LG

TUBE: Tangent Upper Bound on Evidence for Discrete Diffusion Language Models

Log-likelihood is a standard metric for evaluating generative models. Unfortunately, in contrast to autoregressive models (ARMs), discrete diffusion models generally do not admit exact computation of this quantity. Existing evaluations, therefore, rely on the evidence lower bound (ELBO), leaving unclear how much higher the true value may be. We address this by introducing the Tangent Upper Bound on Evidence (TUBE), a variational upper bound on log-likelihood that admits an unbiased Monte Carlo estimator. Our TUBE extends across latent-variable models, including masked diffusion models (MDMs), any-order ARMs (AO-ARMs), and block variants of both. Applied to block MDMs and block AO-ARMs, TUBE reveals our key empirical finding that these models lie strictly below the exact ARM baseline, showing that ARMs still dominate in likelihood.

cs.LG

Diffusion & Adversarial Schrödinger Bridges via Iterative Proportional Markovian Fitting

The Iterative Markovian Fitting (IMF) procedure, which iteratively projects onto the space of Markov processes and the reciprocal class, successfully solves the Schrödinger Bridge (SB) problem. However, an efficient practical implementation requires a heuristic modification -- alternating between fitting forward and backward time diffusion at each iteration. This modification is crucial for stabilizing training and achieving reliable results in applications such as unpaired domain translation. Our work reveals a close connection between the modified version of IMF and the Iterative Proportional Fitting (IPF) procedure -- a foundational method for the SB problem, also known as Sinkhorn's algorithm. Specifically, we demonstrate that the heuristic modification of the IMF effectively integrates both IMF and IPF procedures. We refer to this combined approach as the Iterative Proportional Markovian Fitting (IPMF) procedure. Through theoretical and empirical analysis, we establish the convergence of the IPMF procedure under various settings, contributing to developing a unified framework for solving SB problems. Moreover, from a practical standpoint, the IPMF procedure enables a flexible trade-off between image similarity and generation quality, offering a new mechanism for tailoring models to specific tasks.

cs.LG

InfoBridge: Mutual Information estimation via Bridge Matching

Diffusion bridge models have recently become a powerful tool in the field of generative modeling. In this work, we leverage their power to address another important problem in machine learning and information theory, the estimation of the mutual information (MI) between two random variables. Neatly framing MI estimation as a domain transfer problem, we construct an unbiased estimator for data posing difficulties for conventional MI estimators. We showcase the performance of our estimator on three standard MI estimation benchmarks, i.e., low-dimensional, image-based and high MI, and on real-world data, i.e., protein language model embeddings.

cs.LG

Discrete Bridges for Mutual Information Estimation

Diffusion bridge models in both continuous and discrete state spaces have recently become powerful tools in the field of generative modeling. In this work, we leverage the discrete state space formulation of bridge matching models to address another important problem in machine learning and information theory: the estimation of the mutual information (MI) between discrete random variables. By neatly framing MI estimation as a domain transfer problem, we construct a Discrete Bridge Mutual Information (DBMI) estimator suitable for discrete data, which poses difficulties for conventional MI estimators. We showcase the performance of our estimator on two MI estimation settings: low-dimensional and image-based.

cs.LG

Sampling from Energy distributions with Target Concrete Score Identity

We introduce the Target Concrete Score Identity Sampler (TCSIS), a method for sampling from unnormalized densities on discrete state spaces by learning the reverse dynamics of a Continuous-Time Markov Chain (CTMC). Our approach builds on a forward in time CTMC with a uniform noising kernel and relies on the proposed Target Concrete Score Identity, which relates the concrete score, the ratio of marginal probabilities of two states, to a ratio of expectations of Boltzmann factors under the forward uniform diffusion kernel. This formulation enables Monte Carlo estimation of the concrete score without requiring samples from the target distribution or computation of the partition function. We approximate the concrete score with a neural network and propose two algorithms: Self-Normalized TCSIS and Unbiased TCSIS. Finally, we demonstrate the effectiveness of TCSIS on problems from statistical physics.

cs.LG

Adversarial Schrödinger Bridge Matching

The Schrödinger Bridge (SB) problem offers a powerful framework for combining optimal transport and diffusion models. A promising recent approach to solve the SB problem is the Iterative Markovian Fitting (IMF) procedure, which alternates between Markovian and reciprocal projections of continuous-time stochastic processes. However, the model built by the IMF procedure has a long inference time due to using many steps of numerical solvers for stochastic differential equations. To address this limitation, we propose a novel Discrete-time IMF (D-IMF) procedure in which learning of stochastic processes is replaced by learning just a few transition probabilities in discrete time. Its great advantage is that in practice it can be naturally implemented using the Denoising Diffusion GAN (DD-GAN), an already well-established adversarial generative modeling technique. We show that our D-IMF procedure can provide the same quality of unpaired domain translation as the IMF, using only several generation steps instead of hundreds. We provide the code at https://github.com/Daniil-Selikhanovych/ASBM.

cs.LG

Light and Optimal Schrödinger Bridge Matching

Schrödinger Bridges (SB) have recently gained the attention of the ML community as a promising extension of classic diffusion models which is also interconnected to the Entropic Optimal Transport (EOT). Recent solvers for SB exploit the pervasive bridge matching procedures. Such procedures aim to recover a stochastic process transporting the mass between distributions given only a transport plan between them. In particular, given the EOT plan, these procedures can be adapted to solve SB. This fact is heavily exploited by recent works giving rise to matching-based SB solvers. The cornerstone here is recovering the EOT plan: recent works either use heuristical approximations (e.g., the minibatch OT) or establish iterative matching procedures which by the design accumulate the error during the training. We address these limitations and propose a novel procedure to learn SB which we call the \textbf{optimal Schrödinger bridge matching}. It exploits the optimal parameterization of the diffusion process and provably recovers the SB process \textbf{(a)} with a single bridge matching step and \textbf{(b)} with arbitrary transport plan as the input. Furthermore, we show that the optimal bridge matching objective coincides with the recently discovered energy-based modeling (EBM) objectives to learn EOT/SB. Inspired by this observation, we develop a light solver (which we call LightSB-M) to implement optimal matching in practice using the Gaussian mixture parameterization of the adjusted Schrödinger potential. We experimentally showcase the performance of our solver in a range of practical tasks. The code for our solver can be found at https://github.com/SKholkin/LightSB-Matching.

cs.LG