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Causal Abstraction (CA) theory provides a principled framework for relating causal models that describe the same system at different levels of granularity while ensuring interventional consistency between them. Recent methods for learning…

Machine Learning · Computer Science 2026-01-23 Yorgos Felekis , Theodoros Damoulas , Paris Giampouras

Pure infiniteness (in sense of E.Kirchberg and M.R{\o}rdam) is considered for C*-algebras arising from singly generated dynamical systems. In particular, Cuntz-Krieger algebras and their generalizations, i.e., graph-algebras and O_A of an…

Operator Algebras · Mathematics 2007-05-23 Jacob v. B. Hjelmborg

In a recent paper, J. Chem. Phys. 162, 214101 (2025), a novel approach for the rigidification of a molecular cluster was proposed, in which starting with an all-atom (AA) potential, a coarse-grained (CG) potential for the associated cluster…

Chemical Physics · Physics 2025-09-08 João V. M. Pimentel , Vladimir A. Mandelshtam

The study of dynamical systems on complex networks is of paramount importance in engineering, given that many natural and artificial systems find a natural embedding on discrete topologies. For instance, power grids, chemical reactors and…

Optimization and Control · Mathematics 2024-04-26 Riccardo Muolo , Anthony Hastir , Hiroya Nakao

Understanding how biochemical systems settle into stable states, such as how protein concentrations reach equilibrium, is central to explaining cellular behavior and designing synthetic biological circuits. However, existing analytical…

Dynamical Systems · Mathematics 2026-04-23 Exequiel Jun V. Villejo , Aurelio A. de los Reyes , Bryan S. Hernandez

This paper concerns the long-term behavior of population systems, and in particular of chemical reaction systems, modeled by deterministic mass-action kinetics. We approach two important open problems in the field of Chemical Reaction…

Dynamical Systems · Mathematics 2012-03-21 Casian Pantea

We present conditions which guarantee a parametrization of the set of positive equilibria of a generalized mass-action system. Our main results state that (i) if the underlying generalized chemical reaction network has an effective…

Dynamical Systems · Mathematics 2018-05-24 Matthew D. Johnston , Stefan Müller , Casian Pantea

Criticality is a behavioral state in dynamical systems that is known to present the highest computation capabilities, i.e., information transmission, storage, and modification. Therefore, such systems are ideal candidates as a substrate for…

Neural and Evolutionary Computing · Computer Science 2025-08-14 Sidney Pontes-Filho , Stefano Nichele , Mikkel Lepperød

Steady states of alternating-current (AC) circuits have been studied in considerable detail. In 1982, Baillieul and Byrnes derived an upper bound on the number of steady states in a loss-less AC circuit [IEEE TCAS, 29(11): 724--737] and…

Optimization and Control · Mathematics 2016-11-16 Jakub Marecek , Timothy McCoy , Martin Mevissen

We identify the thermodynamic conditions necessary to observe indefinite growth in homogeneous open chemical reaction networks (CRNs) satisfying mass action kinetics. We also characterize the thermodynamic efficiency of growth by…

Molecular Networks · Quantitative Biology 2024-12-05 Shesha Gopal Marehalli Srinivas , Francesco Avanzini , Massimiliano Esposito

Quantifying the evolution and complexity of materials is of importance in many areas of science and engineering, where a central open challenge is developing experimental complexity measurements to distinguish random structures from evolved…

Materials Science · Physics 2025-02-26 Keith Y Patarroyo , Abhishek Sharma , Ian Seet , Ignas Packmore , Sara I. Walker , Leroy Cronin

Randomly packing spheres of equal size into a container consistently results in a static configuration with a density of ~64%. The ubiquity of random close packing (RCP) rather than the optimal crystalline array at 74% begs the question of…

Soft Condensed Matter · Physics 2016-03-29 Yuliang Jin , Hernan A. Makse

The mechanisms for explaining how a stable asymmetric chemical system can be formed from a symmetric chemical system, in the absence of any asymmetric influence other than statistical fluctuations, have been developed during the last…

Biomolecules · Quantitative Biology 2010-06-15 Raphael Plasson , Axel Brandenburg

Chemical reaction network theory provides powerful tools for rigorously understanding chemical reactions and the dynamical systems and differential equations that represent them. A frequent issue with mathematical analyses of these networks…

Quantitative Methods · Quantitative Biology 2025-12-23 Joseph M. Sauder , Bruce P. Ayati , Ryan Kinser

Embedding computation in biochemical environments incompatible with traditional electronics is expected to have wide-ranging impact in synthetic biology, medicine, nanofabrication and other fields. Natural biochemical systems are typically…

Machine Learning · Computer Science 2022-06-15 Marko Vasic , Cameron Chalk , Austin Luchsinger , Sarfraz Khurshid , David Soloveichik

We introduce a novel self-supervised deep clustering approach tailored for unstructured data without requiring prior knowledge of the number of clusters, termed Adaptive Self-supervised Robust Clustering (ASRC). In particular, ASRC…

Machine Learning · Computer Science 2024-07-31 Chen-Lu Ding , Jiancan Wu , Wei Lin , Shiyang Shen , Xiang Wang , Yancheng Yuan

We develop a new density-based clustering algorithm named CRAD which is based on a new neighbor searching function with a robust data depth as the dissimilarity measure. Our experiments prove that the new CRAD is highly competitive at…

Computation · Statistics 2019-04-09 Xin Huang , Yulia R. Gel

Information geometry is based on classical Legendre duality but allows to incorporate additional structure such as algebraic constraints and Bregman divergence functions. It is naturally suited, and has been successfully used, to describe…

Molecular Networks · Quantitative Biology 2025-03-26 Dimitri Loutchko , Yuki Sughiyama , Tetsuya J. Kobayashi

Matrix completion is one of the crucial tools in modern data science research. Recently, a novel sampling model for matrix completion coined cross-concentrated sampling (CCS) has caught much attention. However, the robustness of the CCS…

Machine Learning · Statistics 2025-04-17 HanQin Cai , Longxiu Huang , Chandra Kundu , Bowen Su

We study the set of output stable configurations of chemical reaction deciders (CRDs). It turns out that CRDs with only bimolecular reactions (which are almost equivalent to population protocols) have a special structure that allows for an…

Computational Complexity · Computer Science 2015-06-16 Robert Brijder
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