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Monte Carlo criticality simulations are widely used in nuclear safety demonstrations, as they offer an arbitrarily precise estimation of global and local tallies while making very few assumptions. However, since the inception of such…

Monte Carlo methods are essential across diverse scientific fields, yet their efficiency is frequently hampered by critical slowing down-a sharp increase in autocorrelation times near phase transitions. Although deep learning approaches,…

机器学习 · 计算机科学 2026-05-18 Piotr Białas , Piotr Korcyl , Tomasz Stebel , Dawid Zapolski

When combined with highly expressive ansatz functions such as neural quantum states, variational Monte Carlo (VMC) constitutes a versatile numerical approach to tackle the quantum many-body problem in and out of equilibrium. However, its…

量子物理 · 物理学 2026-05-06 Wladislaw Krinitsin , Markus Schmitt

We study the problem of estimating the optimal Q-function of $\gamma$-discounted Markov decision processes (MDPs) under the synchronous setting, where independent samples for all state-action pairs are drawn from a generative model at each…

机器学习 · 统计学 2025-05-27 Mohammad Boveiri , Peyman Mohajerin Esfahani

We consider the problem of learning a target probability distribution over a set of $N$ binary variables from the knowledge of the expectation values (with this target distribution) of $M$ observables, drawn uniformly at random. The space…

统计力学 · 物理学 2015-09-02 Tomoyuki Obuchi , Simona Cocco , Rémi Monasson

Sampling efficiency is a key bottleneck in reinforcement learning with verifiable rewards. Existing group-based policy optimization methods, such as GRPO, allocate a fixed number of rollouts for all training prompts. This uniform allocation…

机器学习 · 计算机科学 2026-03-06 Hieu Trung Nguyen , Bao Nguyen , Wenao Ma , Yuzhi Zhao , Ruifeng She , Viet Anh Nguyen

In the field of computational physics and material science, the efficient sampling of rare events occurring at atomic scale is crucial. It aids in understanding mechanisms behind a wide range of important phenomena, including protein…

机器学习 · 计算机科学 2024-01-17 Xinru Hua , Rasool Ahmad , Jose Blanchet , Wei Cai

In this paper the choice of the Bernoulli distribution as biased distribution for importance sampling (IS) Monte-Carlo (MC) simulation of linear block codes over binary symmetric channels (BSCs) is studied. Based on the analytical…

信息论 · 计算机科学 2013-11-07 Gianmarco Romano , Domenico Ciuonzo

Deep neural networks, when optimized with sufficient data, provide accurate representations of high-dimensional functions; in contrast, function approximation techniques that have predominated in scientific computing do not scale well with…

数据分析、统计与概率 · 物理学 2021-03-15 Grant M. Rotskoff , Andrew R. Mitchell , Eric Vanden-Eijnden

To efficiently evaluate system reliability based on Monte Carlo simulation, importance sampling is used widely. The optimal importance sampling density was derived in 1950s for the deterministic simulation model, which maps an input to an…

统计方法学 · 统计学 2019-06-04 Quoc Dung Cao , Youngjun Choe

Gaussian Process (GPs) models are a rich distribution over functions with inductive biases controlled by a kernel function. Learning occurs through the optimisation of kernel hyperparameters using the marginal likelihood as the objective.…

机器学习 · 统计学 2021-11-22 Fergus Simpson , Vidhi Lalchand , Carl Edward Rasmussen

Designing manufacturing processes with high yield and strong reliability relies on effective methods for rare event estimation. Genealogical importance splitting reduces the variance of rare event probability estimators by iteratively…

机器学习 · 计算机科学 2022-01-03 Malik Hassanaly , Andrew Glaws , Ryan N. King

This paper investigates adaptive importance sampling algorithms for which the policy, the sequence of distributions used to generate the particles, is a mixture distribution between a flexible kernel density estimate (based on the previous…

统计理论 · 数学 2020-03-23 Bernard Delyon , François Portier

The aim of this paper is to introduce a new Monte Carlo method based on importance sampling techniques for the simulation of stochastic differential equations. The main idea is to combine random walk on squares or rectangles methods with…

概率论 · 数学 2010-10-22 Madalina Deaconu , Antoine Lejay

Extracting consistent statistics between relevant free-energy minima of a molecular system is essential for physics, chemistry and biology. Molecular dynamics (MD) simulations can aid in this task but are computationally expensive,…

化学物理 · 物理学 2024-04-17 Ana Molina-Taborda , Pilar Cossio , Olga Lopez-Acevedo , Marylou Gabrié

Adaptive importance sampling is a widely spread Monte Carlo technique that uses a re-weighting strategy to iteratively estimate the so-called target distribution. A major drawback of adaptive importance sampling is the large variance of the…

统计理论 · 数学 2021-11-01 Anna Korba , François Portier

Graph Convolutional Networks (GCNs) have achieved impressive empirical advancement across a wide variety of semi-supervised node classification tasks. Despite their great success, training GCNs on large graphs suffers from computational and…

机器学习 · 计算机科学 2021-11-02 Weilin Cong , Morteza Ramezani , Mehrdad Mahdavi

Monte Carlo estimation in plays a crucial role in stochastic reaction networks. However, reducing the statistical uncertainty of the corresponding estimators requires sampling a large number of trajectories. We propose control variates…

统计方法学 · 统计学 2021-10-19 Michael Backenköhler , Luca Bortolussi , Verena Wolf

Recent progress in deep latent variable models has largely been driven by the development of flexible and scalable variational inference methods. Variational training of this type involves maximizing a lower bound on the log-likelihood,…

机器学习 · 计算机科学 2016-06-02 Andriy Mnih , Danilo J. Rezende

This paper presents an algorithm to obtain an event-based video from noisy frames given by physics-based Monte Carlo path tracing over a synthetic 3D scene. Given the nature of dynamic vision sensor (DVS), rendering event-based video can be…

计算机视觉与模式识别 · 计算机科学 2024-04-17 Yuta Tsuji , Tatsuya Yatagawa , Hiroyuki Kubo , Shigeo Morishima