A new method for sampling from complex distributions using Langevin samplers.
problem Sampling from unnormalized Boltzmann densities.
method Probability flow ODE derived from linear stochastic interpolants, employing Langevin samplers.
result Efficient simulation of the flow with non-asymptotic convergence rate.
A new sequential test for unnormalized densities.
problem Testing unnormalized densities with adaptive stopping.
method Sequential kernelized Stein discrepancy test, using non-uniform Stein kernels.
result Valid test with asymptotic lower bound for growth.
iEFM trains CNF models from unnormalized densities efficiently.
problem Training generators from energy functions or unnormalized densities.
method Iterated energy-based flow matching (iEFM) with simulation-free objective.
result iEFM outperforms existing methods in probabilistic modeling.
iDEM generates samples from Boltzmann densities without data.
problem Generating statistically independent samples from unnormalized distributions.
method Iterative algorithm using energy and gradient for diffusion-based sampler training.
result iDEM achieves state-of-the-art performance and trains faster than existing methods.
Flow AIS Bootstrap improves flow training by generating samples in hard-to-reach regions.
problem Training flows with high variance and mode-seeking behavior.
method Augment flows with AIS and minimize α-divergence with α=2. result FAB learns Boltzmann distribution of alanine dipeptide without MD samples.
New method estimates model discrepancy without sampling for unnormalized models.
problem Evaluating and training unnormalized density models efficiently.
method Estimate Stein discrepancy using neural network parameterized vector function.
result Method outperforms existing goodness-of-fit tests and training methods.
REGS samples from unnormalized distributions using gradient flow and neural networks.
problem Sampling from unnormalized distributions with high accuracy and efficiency.
method REGS is a particle method that iteratively transforms samples from a reference distribution to match an unnormalized target distribution using Wasserstein gradient flow and neural networks.
result REGS outperforms state-of-the-art methods in sampling from challenging multimodal distributions and real datasets.
New method trains neural samplers to sample from multi-modal distributions efficiently.
problem Mode-seeking behavior of reverse KL divergence hinders effective sampling from multi-modal target distributions.
method Minimizing reverse diffusive KL divergence along diffusion trajectories of model and target densities.
result Demonstrated enhanced sampling performance across various multi-modal distributions.
The probability density function for the visible sector of a Riemann-Theta Boltzmann machine can be taken conditional on a subset of the visible units. We derive that the corresponding conditional density function is given by a reparameterization of the Riemann-Theta Boltzmann machine modelling the original probability…
Paper presents a new method to learn unnormalized models efficiently.
problem Scalability issues in score matching for flexible unnormalized models.
method Connects learning objectives to Wasserstein gradient flows for scalability.
result Demonstrates improved learning of unnormalized models on manifolds.
Despite their exceptional flexibility and popularity, the Monte Carlo methods often suffer from slow mixing times for challenging statistical physics problems. We present a general strategy to overcome this difficulty by adopting ideas and techniques from the machine learning community. We fit the unnormalized probabil…
We investigate adversarial learning in the case when only an unnormalized form of the density can be accessed, rather than samples. With insights so garnered, adversarial learning is extended to the case for which one has access to an unnormalized form u(x) of the target density function, but no samples. Further, new c…
A new machine learning model uses score matching to estimate probability densities efficiently.
problem Estimating probability density functions is challenging.
method Introduced a product Jacobi-Theta Boltzmann machine (pJTBM) and used score matching for efficient fitting.
result The pJTBM can fit probability densities more efficiently than the RTBM using score matching.
Several statistical models are given in the form of unnormalized densities, and calculation of the normalization constant is intractable. We propose estimation methods for such unnormalized models with missing data. The key concept is to combine imputation techniques with estimators for unnormalized models including no…
PDDS samples from unnormalized densities using iterative particle scheme.
problem Sampling from unnormalized probability densities.
method Iterative particle scheme with novel score matching loss.
result Asymptotically consistent estimates for multimodal and high-dimensional tasks.
Unified empirical and variational Bayes for unnormalized densities.
problem Approximating unnormalized densities using latent variable models.
method Formulate a latent variable model for Y=X+N(0,σ2Id), use ELBO as parametrization of Y's energy function, and estimate X with empirical Bayes least-squares. result UVB has higher capacity to approximate energy functions than MLPs in DEEN.
New BGs use diffusion models to improve sampling from complex distributions.
problem Sampling from complex, multi-modal distributions is challenging.
method Combines diffusion models with annealed Monte Carlo for improved sampling.
result Second-order denoising kernels can improve performance in high-dimensional spaces.
We develop underdamped diffusion bridges for sampling from unnormalized densities.
problem Sampling from unnormalized densities without direct access to samples.
method Underdamped diffusion bridges with rigorous score matching equivalence.
result State-of-the-art performance in sampling across various problems.
Neural density estimators are flexible families of parametric models which have seen widespread use in unsupervised machine learning in recent years. Maximum-likelihood training typically dictates that these models be constrained to specify an explicit density. However, this limitation can be overcome by instead using …
New method minimizes robust density power-based divergences for general parametric densities.
problem Computational complexity of minimizing DPD for general parametric densities.
method Stochastic approach to minimize DPD for general parametric density models.
result Proposed method can be applied to minimize other density power-based γ-divergences.
Proposes a method combining CNFs and rejection-resampling for sampling from unnormalized densities.
problem Sampling from unnormalized probability densities, especially multimodal ones.
method Combines continuous normalizing flows with rejection-resampling steps based on importance weights.
result The method improves sampling accuracy and performance compared to state-of-the-art methods.
EWFM trains continuous flows with only energy evaluations, improving sample quality with fewer computations.
problem Efficiently sampling from complex, high-dimensional Boltzmann distributions using only energy evaluations.
method Energy-Weighted Flow Matching (EWFM) using importance sampling and iterative/annealed training.
result Improved sample quality with up to 3 orders of magnitude fewer energy evaluations compared to existing methods.
We show that the visible sector probability density function of the Riemann-Theta Boltzmann machine corresponds to a gaussian mixture model consisting of an infinite number of component multi-variate gaussians. The weights of the mixture are given by a discrete multi-variate gaussian over the hidden state space. This a…
A new training method for normalizing flows without samples.
problem Training normalizing flows without samples but with energy functions.
method Interpolates energy functions to find a transport vector field.
result Optimizes transport vector field and energy function to satisfy continuity equation.
The parameter estimation of unnormalized models is a challenging problem. The maximum likelihood estimation (MLE) is computationally infeasible for these models since normalizing constants are not explicitly calculated. Although some consistent estimators have been proposed earlier, the problem of statistical efficienc…
DO-EM framework for quantum models improves generative tasks.
problem Lack of Expectation-Maximization framework for density operators.
method Demonstrated inequality for density operators, derived DO-EM framework.
result DO-EM framework outperforms probabilistic models in generative tasks.
A general Boltzmann machine with continuous visible and discrete integer valued hidden states is introduced. Under mild assumptions about the connection matrices, the probability density function of the visible units can be solved for analytically, yielding a novel parametric density function involving a ratio of Riema…
ASBS improves sampling from Boltzmann distributions without importance weighting.
problem Sampling from Boltzmann distributions with known energies but unknown samples.
method Adjoint Schrödinger Bridge Sampler using kinetic-optimal transportation.
result ASBS achieves scalable and efficient sampling without importance weighting.
Graph clustering improved using Boltzmann machine heuristics.
problem Graph clustering to form densely connected clusters.
method Two mathematical programming formulations, two variations of Boltzmann machine heuristic.
result Boltzmann machine provides superior solutions and faster computation times.
New CUSUM algorithm detects changes in unnormalized models.
problem Change detection in models with unknown normalization constants.
method Score-based CUSUM (SCUSUM) algorithm based on Fisher divergence and Hyvärinen score.
result Asymptotic optimality of the SCUSUM algorithm demonstrated.
Graph Laplace operators uniquely identify metrics and densities on manifolds.
problem Identifying Riemannian metrics and sampling densities from graph Laplace operators.
method Analyzing intrinsic and extrinsic graph Laplace operators on compact Riemannian manifolds.
result Graph Laplace operators uniquely determine metrics and densities under certain conditions.
We introduce a new family of estimators for unnormalized statistical models. Our family of estimators is parameterized by two nonlinear functions and uses a single sample from an auxiliary distribution, generalizing Maximum Likelihood Monte Carlo estimation of Geyer and Thompson (1992). The family is such that we can e…
New sampling method uses gradient-free IPS with RKHS velocity field.
problem Efficient sampling from unnormalized target densities.
method Gradient-free interacting particle systems (IPS) with RKHS velocity field.
result IPS produce high-quality samples from various target distributions.
LFIS uses a time-dependent velocity field to sample from complex distributions.
problem Sampling from unnormalized density functions.
method LFIS learns a time-dependent velocity field to transport samples from a simple initial distribution to a complex target distribution.
result LFIS achieves state-of-the-art performance on various benchmark problems.
Novel filter uses deep BSDE for nonlinear density approximation.
problem Nonlinear filtering problem.
method Bayesian filter based on deep BSDE and neural networks.
result Theoretical convergence rate confirmed in numerical examples.
In 1870s, L. Boltzmann proved the famous H-theorem for the Boltzmann equation in the kinetic theory of gas and gave the statistical interpretation of the thermodynamic entropy. In 2002, G. Perelman introduced the notion of W-entropy and proved the W-entropy formula for the Ricci flow. This plays a crucial role in…
DDS samples from noisy data by reversing diffusion, providing theoretical guarantees.
problem Sampling from unnormalized densities.
method Denoising diffusion process, score matching, optimal control, Schrödinger bridges.
result DDS provides theoretical guarantees for sampling.
SoftCVI uses contrastive estimation to infer complex posteriors.
problem Estimating complex posteriors in Bayesian inference.
method Contrastive variational inference with self-generated soft labels.
result SoftCVI outperforms other variational approaches in stability and coverage.
A new method called TemperFlow tackles multimodality in sampling from unnormalized distributions.
problem Sampling from unnormalized distributions with isolated modes.
method TemperFlow learns a sequence of tempered distributions to progressively approach the target distribution.
result TemperFlow overcomes the limitations of existing methods and achieves superior performance.
Unified framework for OOD detection using class ratio estimation.
problem Density-based OOD detection is unreliable for OOD images.
method Unified framework that builds energy-based models and employs differing base distributions, directly estimating the density ratio through class ratio estimation.
result Competitive results on OOD image problems compared to recent work.
Morse neural networks improve uncertainty quantification and detection.
problem Uncertainty quantification and out-of-distribution detection.
method Generalizes unnormalized Gaussian densities to high-dimensional submanifolds using KL-divergence loss.
result Unified approach for OOD detection, anomaly detection, and continuous learning.
Combines SMC and diffusion-based samplers for improved sampling performance.
problem Sampling from unnormalized densities efficiently and robustly.
method Viewing SMC and diffusion-based samplers as continuous-time processes, SCLD combines their strengths.
result SCLD achieves improved performance on multiple benchmark problems with less training budget.
New method for sampling from complex distributions using stochastic localization.
problem Sampling from unnormalized target densities in multi-modal distributions.
method Stochastic Localization via Iterative Posterior Sampling (SLIPS) framework.
result Approximate samples from target distribution and denoiser learned iteratively.
A new method optimizes a generalized Kullback-Leibler divergence for better simulation-based inference.
problem Optimizing likelihood functions when they are only known implicitly.
method Optimizes a generalized Kullback-Leibler divergence that accounts for normalization constants in unnormalized distributions.
result Unified approach that combines Neural Posterior Estimation and Neural Ratio Estimation.
Paper introduces a new sampling method combining Consistency Models with importance sampling.
problem Inherent errors in samples and high NFEs for high-quality samples in Boltzmann distributions.
method Combines Consistency Models with importance sampling to produce unbiased samples with minimal NFEs.
result Produces unbiased samples using only 6-25 NFEs, comparable to 100 NFEs for DDPMs.
Truncated densities are probability density functions defined on truncated domains. They share the same parametric form with their non-truncated counterparts up to a normalizing constant. Since the computation of their normalizing constants is usually infeasible, Maximum Likelihood Estimation cannot be easily applied t…
Unified view on learning unnormalized distributions using NCE.
problem Learning unnormalized distributions across different communities.
method Noise-Contrastive Estimation (NCE) for a unified perspective.
result Established finite-sample convergence rates for exponential families.
DPS uses PINNs to estimate drift in diffusion models for sampling.
problem Accurately estimating drift term in reverse SDE from unnormalized density.
method Diffusion-PINN Sampler (DPS) solves PINN for log-density of SDE marginals.
result DPS achieves convergence guarantees and accurately samples complex distributions.