RC flow learns molecular kinetics in low dimensions.
problem Discovering interpretable low-dimensional models of molecular kinetics.
method Normalizing flow for coordinate transformation and Brownian dynamics for kinetics approximation.
result Tractable and trainable model of reduced kinetics in continuous time and space.
The paper extends Vlasov kinetic theory to time-dependent dynamics using cosymplectic and cocontact manifolds.
problem Extending Vlasov kinetic theory to time-dependent dynamics.
method Introducing geometric kinetic theories within cosymplectic and cocontact manifolds.
result Alternative realizations of cosymplectic and cocontact kinetic theories linked via Poisson/momentum maps.
Analysis of Vlasov plasma dynamics using matched pair Lie-Poisson formulation.
problem Understanding the dynamics of Vlasov plasma and its kinetic moments.
method Hamiltonian (Lie-Poisson) analysis and matched pair decomposition.
result Observation of mutual interactions between subdynamics in Vlasov plasma.
This paper analyzes how kinetic terms in stock market equations can affect symmetry breaking.
problem Spontaneous symmetry breaking in quantum finance and its impact on stock market dynamics.
method Analyzes the role of kinetic terms in the context of the martingale condition in stock market equations.
result Kinetic terms can shift the effective location of the vacuum state, affecting symmetry breaking patterns.
New methods improve efficiency of sampling algorithms for complex systems.
problem Efficiently sampling from complex, high-dimensional probability distributions.
method Randomized Runge-Kutta-Nyström methods tailored for Hamiltonian flows.
result Quantitative 5/2-order L2-accuracy in approximating Hamiltonian flows. Unified framework for continuous-state discrete flow matching models.
problem Discrete generative modeling with continuous probabilities.
method Introducing α-Flow, a family of CS-DFM models based on information geometry. result Optimal flow matching loss for α-flow minimizes generalized kinetic energy. Grey-box model combines GP with motion data to analyze skiing forces.
problem Analyzing forces in cross-country skiing races.
method Combines motion model formulae with Gaussian process regression.
result Grey-box approach reduces predictive uncertainty by 30-40%.
Paper extends port-Hamiltonian model to include internal energy for compressible and incompressible flow.
problem Modeling fluid flow dynamics with internal energy and constraints.
method Derived port-Hamiltonian model using interconnection maps and added internal energy and constraint forces.
result Model accurately represents both compressible and incompressible fluid flow.
We study the heat flow in the loop space of a closed Riemannian manifold M as an adiabatic limit of the Floer equations in the cotangent bundle. Our main application is a proof that the Floer homology of the cotangent bundle, for the Hamiltonian function kinetic plus potential energy, is naturally isomorphic to the h…
This study examines biases in flow matching samplers using finite-sample estimation.
problem Biases in flow matching samplers when using finite-sample surrogates.
method Finite-sample plug-in estimation and hierarchy of empirical FM models.
result Exact empirical minimizer and smoothed plug-in regime identified for affine conditional flows.
MFM improves generative model interpolations by learning approximate geodesics on data manifolds.
problem Straight interpolations fail to capture dynamics on data manifolds.
method Metric Flow Matching (MFM) learns approximate geodesics by minimizing kinetic energy of a data-induced Riemannian metric.
result MFM outperforms Euclidean baselines, achieving SOTA on single-cell trajectory prediction.
Proposes new genetic algorithm rule for market competition.
problem Market competition genetic algorithm rules.
method Econophysics kinetic market model as an evolutionary algorithm.
result New replacement rule for genetic algorithms.
Researchers infer gene activity in dividing cells, accounting for protein inheritance and division history.
problem Inferring protein production kinetics in dividing cells due to protein inheritance and division history.
method Adapted conditional normalizing flows to approximate intractable likelihoods from simulated data.
result Glc3 gene is mostly inactive under stress, with brief and transient expression.
This work improves chemistry modeling by jointly learning reaction progress variables and look-up models.
problem Jointly modeling turbulent combustion requires solving both chemistry and flow systems simultaneously, which is computationally expensive.
method Developed a deep neural network architecture that jointly learns reaction progress variables and look-up models, improving accuracy.
result Joint learning yields more accurate results in chemistry modeling.
In this article, we briefly review the different aspects and applications of kinetic exchange models in economics and sociology. Our main aim is to show in what manner the kinetic exchange models for closed economic systems were inspired by the kinetic theory of gas molecules. The simple yet powerful framework of kinet…
New method trains deep neural networks for non-interacting kinetic-energy functionals in DFT.
problem Lack of exact relationship between electron density and non-interacting kinetic energy.
method Variational principle to regularize machine-learned density functionals.
result Excellent results on kinetic-energy functionals for various systems.
CLWF improves time series imputation speed and accuracy.
problem Slow convergence in diffusion model-based imputation methods.
method CLWF uses Lagrangian mechanics to learn velocity and integrates a denoising autoencoder to estimate gradient.
result CLWF outperforms state-of-the-art imputation approaches.
Study finds conjugate points in geodesics of Kolmogorov flows on torus.
problem Characterizing pairs of integers (m,n) for which geodesics have conjugate points.
method Analysis of geodesics in the group of volume-preserving diffeomorphisms of a torus using stream functions.
result Existence of conjugate points for all pairs of strictly positive integers (m,n).
Paper proposes a smart neck-band for detecting neck postures using integrated kinematic and kinetic data.
problem Improper neck postures lead to musculoskeletal disorders requiring therapy and rehabilitation.
method Integrated use of kinematic and kinetic data with machine learning algorithms.
result 100% accuracy in predicting neck postures using the proposed platform.
New method uses machine learning to analyze catalyst reactions.
problem Understanding complex reaction mechanisms in catalytic materials.
method Combining transient kinetics and machine learning.
result Correct estimates of micro-kinetic coefficients and mechanism.
We briefly review results on nonlinear kinetic equation of Boltzmann type which describe the evolution of wealth in a simple agents market. The mathematical structure of the underlying kinetic equations allows to use well-known techniques of wide use in kinetic theory of rarefied gases to obtain information on the proc…
Study explores how wealth dynamics change with preferential interactions in kinetic exchange models.
problem Investigate how preferential interactions affect wealth dynamics and distributions in kinetic exchange models.
method Conducted Monte Carlo simulations to explore two types of preferential interactions: one with random selection and another with wealth difference constraint.
result Emergence of quasi-oligarchic societies and segregation into economic classes observed in preferential interactions.
Automated method creates compact chemical models from detailed ones, reducing complexity and improving accuracy.
problem Creating accurate low-dimensional chemical kinetic models from detailed ones is time-consuming and requires expert knowledge.
method Machine Learned Optimisation of Chemical Kinetics (MLOCK) algorithm systematically perturbs sub-models to find optimal compact models.
result Compact models (15 species) retain ~87% fidelity to detailed models, outperforming previous methods.
LSS learns molecular trajectories from MD data.
problem Limited integration time steps in MD simulations.
method Three deep learning networks for slow collective variables, dynamics, and configuration reconstruction.
result Generates ultra-long synthetic folding trajectories.
Exact solution found for two-body financial dealer model using kinetic theory.
problem Finding an exact solution for the two-body financial dealer model.
method Exact master-Liouville equations derived using kinetic theory and probability currents.
result Exact order-book profile and average transaction interval derived.
Improved KLMC for sampling under various conditions.
problem Stable simulation of kinetic Langevin dynamics under different parameters.
method Revisited synchronous Wasserstein coupling analysis with stochastic exponential Euler discretization.
result Exponential integrator can simulate kinetic Langevin dynamics in the overdamped regime with proper time acceleration.
Study on kinetic Langevin diffusions and their couplings, showing subtle TV bounds and new non-Markovian couplings.
problem Understanding and quantifying the TV distance between solutions of kinetic Langevin diffusions with different initial values.
method Established new non-Markovian couplings for kinetic Langevin diffusions, derived from optimal coalescence trajectories, and analyzed their TV bounds.
result No Markovian coupling can capture the asymptotic decay rate of the TV distance between solutions of kinetic Langevin diffusions with different initial values.
We study a minimalist kinetic model for economies. A system of agents with local trading rules display emergent demand behaviour. We examine the resulting wealth distribution to look for non-thermal behaviour. We compare and contrast this model with other similar models.
Learning kinetic systems from data is one of the core challenges in many fields. Identifying stable models is essential for the generalization capabilities of data-driven inference. We introduce a computationally efficient framework, called CausalKinetiX, that identifies structure from discrete time, noisy observations…
Bayesian inference over admissible histories leads to irreversible kinetics.
problem Modeling irreversible processes in systems with uncertain histories.
method A Gibbs-type measure weighted by energy-dissipation action and observation constraints, interpreted as a Bayesian posterior.
result The measure concentrates on maximum-a-posteriori (MAP) histories, recovering classical deterministic evolution.
In this paper, we consider a simple kinetic model of economy involving both exchanges between agents and speculative trading. We show that the kinetic model admits non trivial quasi-stationary states with power law tails of Pareto type. In order to do this we consider a suitable asymptotic limit of the model yielding a…
This study improves state estimation for nonlinear systems using conditional normalizing flows.
problem Performance degradation of traditional filtering algorithms in nonlinear systems with non-Gaussian uncertainty.
method Uses conditional normalizing flows with MLP, transformer, or state-space models for state and parameter estimation.
result Optimal-transport-inspired kinetic loss mitigates overparameterization in flows.
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…
Paper develops a new fluid flow model with energy exchange through boundaries.
problem Modeling ideal fluid flow with energy exchange through boundaries.
method Port-Hamiltonian model based on Stokes-Dirac structures.
result Wide range of fluid dynamical systems can be achieved with this model.
A new geometric method approximates slow invariant manifolds without explicit time-scale separation.
problem Approximating slow invariant manifolds in systems with multiple time-scales.
method Geodesic Stretching and Flow Curvature methods translated into tensorial constructions of Riemannian geometry.
result The method approximates normally attracting invariant manifolds without requiring explicit time-scale separation.
New non-kinetic actions on four-manifolds discovered.
problem Finding non-kinetic smooth homotopy coherent actions on four-manifolds.
method Restricting a nontrivial action on a K3 surface and constructing extensions. result First example of a non-kinetic smooth homotopy coherent action of order two on a four-manifold.
This paper optimizes paths for generative models using kinetic energy.
problem Improving generative model performance and sample quality.
method Investigating and optimizing Gaussian probability paths with kinetic energy.
result Kinetic optimal Gaussian paths simplify particle trajectories and improve model performance.
We derive a diffusion approximation for the kinetic Vlasov-Fokker-Planck equation in bounded spatial domains with specular reflection type boundary conditions. The method of proof involves the construction of a particular class of test functions to be chosen in the weak formulation of the kinetic model. This involves t…
Kinetic exchange models have been successful in explaining the shape of the income/wealth distribution in the economies. However, such models usually make some ad-hoc assumptions when it comes to determining the savings factor. Here, we examine a few models in and out of the domain of standard neo-classical economics t…
Stochastic approach improves neural network training for kinetic simulations.
problem Training neural networks under physical constraints in kinetic fusion simulations.
method Stochastic augmented Lagrangian approach using pyTorch.
result Higher model prediction accuracy achieved compared to fixed penalty method.
Compact models for methane/air combustion reduce complexity without sacrificing accuracy.
problem Creating accurate, computationally efficient models for methane combustion.
method Data-oriented three-step methodology: 1) Remove non-essential species, 2) Numerically optimize to key species profiles, 3) Machine learning to refine parameters.
result Produced 19 and 15 species compact models that outperform current state-of-the-art models in accuracy and range of conditions.
There is an increasing demand for computing the relevant structures, equilibria and long-timescale kinetics of biomolecular processes, such as protein-drug binding, from high-throughput molecular dynamics simulations. Current methods employ transformation of simulated coordinates into structural features, dimension red…
Paper predicts turbulent flows using physics-informed deep learning.
problem Predicting turbulent flows from fluid simulations.
method Hybrid approach combining RANS and LES with trainable spectral filters and U-net.
result Significant reduction in prediction error for 60 frames ahead.
The use of kinetic modelling based on partial differential equations for the dynamics of stock price formation in financial markets is briefly reviewed. The importance of behavioral aspects in market booms and crashes and the role of agents' heterogeneity in emerging power laws for price distributions is emphasized and…
Paper proposes new Langevin samplers for sampling from log-concave distributions with superlinear gradient growth.
problem Sampling from log-concave distributions with superlinear gradient growth.
method Proposes two novel discretizations of kinetic Langevin SDEs, showing contractivity and log-Sobolev inequality.
result Establishes non-asymptotic bounds in 2-Wasserstein distance between sampled distributions and target measures.
We discuss certain recent mathematical advances, mainly due to Perelman, in the theory of Ricci flows and their relevance for renormalization group (RG) flows. We consider nonlinear sigma models with closed target manifolds supporting a Riemannian metric, dilaton, and 2-form B-field. By generalizing recent mathematical…
We introduce and analyze a linear kinetic model that describes the evolution of the probability density of the number of firms in a society, in which the microscopic rate of change obeys to the so-called law of proportional effect proposed by Gibrat. Despite its apparent simplicity, the possible mean field limits of th…
New proof shows nonholonomic motions are geodesics, minimizing distance.
problem Nonholonomic motion equations are not variational.
method Proved geodesic property of nonholonomic trajectories using Riemannian metrics.
result Nonholonomic motions minimize distance in their manifold.