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In "equation-free" multiscale computation a dynamic model is given at a fine, microscopic level; yet we believe that its coarse-grained, macroscopic dynamics can be described by closed equations involving only coarse variables. These…

Cellular Automata and Lattice Gases · Physics 2009-11-10 R. Rico-Martinez , C. W. Gear , I. G. Kevrekidis

Coarse-graining is central to reducing dimensionality in molecular dynamics, and is typically characterized by a mapping which projects the full state of the system to a smaller class of variables. While extensive literature has been…

Probability · Mathematics 2020-01-08 Frédéric Legoll , Tony Lelièvre , Upanshu Sharma

We describe a novel framework for estimating subsurface properties, such as rock permeability and porosity, from time-lapse observed seismic data by coupling full-waveform inversion, subsurface flow processes, and rock physics models. For…

Geophysics · Physics 2020-05-06 Dongzhuo Li , Kailai Xu , Jerry M. Harris , Eric Darve

Free energy landscapes encode the kinetics, intermediates, and transition states that govern molecular processes and are thus a key target of single biomolecule research. Typical approaches to deriving optimal, error-minimizing,…

Biological Physics · Physics 2025-11-25 Oliver Cheng , Zosia Adamska , Michael P. Brenner , Megan C. Engel

Optimizing objective functions subject to constraints is fundamental in many real-world applications. However, these constraints are often not readily defined and must be inferred from expert agent behaviors, a problem known as Inverse…

Machine Learning · Computer Science 2025-05-19 Bo Yue , Jian Li , Guiliang Liu

Iterative geostatistical seismic inversion integrates seismic and well data to infer the spatial distribution of subsurface elastic properties. These methods provide limited assessment to the spatial uncertainty of the inverted elastic…

High-dimensional random landscapes underlie phenomena as diverse as glassy physics and optimization in machine learning, and even their simplest toy models already display extraordinarily rich behavior. This thesis aims to deepen our…

Disordered Systems and Neural Networks · Physics 2025-10-28 Alessandro Pacco

Quantifying stochastic processes is essential to understand many natural phenomena, particularly in biology, including cell-fate decision in developmental processes as well as genesis and progression of cancers. While various attempts have…

Statistical Mechanics · Physics 2017-06-28 Ying Tang , Ruoshi Yuan , Gaowei Wang , Xiaomei Zhu , Ping Ao

Solving inverse problems in physics is central to understanding complex systems and advancing technologies in various fields. Iterative optimization algorithms, commonly used to solve these problems, often encounter local minima, chaos, or…

Machine Learning · Computer Science 2025-01-29 Girnar Goyal , Philipp Holl , Sweta Agrawal , Nils Thuerey

The employment of intelligent reflecting surfaces (IRSs) is a potential and promising solution to increase the spectral and energy efficiency of wireless communication networks. Despite their many advantages, IRS-aided communications have…

Information Theory · Computer Science 2021-03-26 Constantinos Psomas , Ioannis Krikidis

The complexity and unpredictability of postbuckling responses in even simple thin shells have raised great challenges to emerging technologies exploiting buckling transitions. Here we comprehensively survey the buckling landscapes to show…

Materials Science · Physics 2019-10-22 Jack Panter , Junbo Chen , Teng Zhang , Halim Kusumaatmaja

We show how the localization landscape, originally introduced to bound low energy eigenstates of disordered wave media and many-body quantum systems, can form the basis for hardware-efficient quantum algorithms for solving binary…

Quantum Physics · Physics 2023-07-06 Benjamin Y. L. Tan , Beng Yee Gan , Daniel Leykam , Dimitris G. Angelakis

Efficient exploration remains a challenging problem in reinforcement learning, especially for those tasks where rewards from environments are sparse. A commonly used approach for exploring such environments is to introduce some "intrinsic"…

Machine Learning · Computer Science 2020-07-16 Neale Ratzlaff , Qinxun Bai , Li Fuxin , Wei Xu

We describe an effective landscape introduced in [1] for the analysis of Constraint Satisfaction problems, such as Sphere Packing, K-SAT and Graph Coloring. This geometric construction reexpresses these problems in the more familiar terms…

Quantum Physics · Physics 2008-09-25 Florent Krzakala , Jorge Kurchan

In this paper, we consider the problem of building learning agents that can efficiently learn to navigate in constrained environments. The main goal is to design agents that can efficiently learn to understand and generalize to different…

Machine Learning · Computer Science 2020-03-04 Kei Ota , Yoko Sasaki , Devesh K. Jha , Yusuke Yoshiyasu , Asako Kanezaki

The traditional way of tackling discrete optimization problems is by using local search on suitably defined cost or fitness landscapes. Such approaches are however limited by the slowing down that occurs when the local minima that are a…

Disordered Systems and Neural Networks · Physics 2018-06-15 Konstantin Klemm , Anita Mehta , Peter F. Stadler

We present a geometric multilevel optimization approach that smoothly incorporates box constraints. Given a box constrained optimization problem, we consider a hierarchy of models with varying discretization levels. Finer models are…

Optimization and Control · Mathematics 2024-04-23 Sebastian Müller , Stefania Petra , Matthias Zisler

Exploratory landscape analysis and fitness landscape analysis in general have been pivotal in facilitating problem understanding, algorithm design and endeavors such as automated algorithm selection and configuration. These techniques have…

Neural and Evolutionary Computing · Computer Science 2024-02-27 Raphael Patrick Prager , Heike Trautmann

We describe and implement iMapD, a computer-assisted approach for accelerating the exploration of uncharted effective Free Energy Surfaces (FES), and more generally for the extraction of coarse-grained, macroscopic information from…

Hard combinatorial optimization problems deal with the search for the minimum cost solutions (ground states) of discrete systems under strong constraints. A transformation of state variables may enhance computational tractability. It has…

Disordered Systems and Neural Networks · Physics 2012-04-11 Konstantin Klemm , Anita Mehta , Peter F. Stadler
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