Cover Image

Iterative variational learning of committor-consistent transition pathways using artificial neural networks

Fuente: arXiv

Saved in:

Bibliographic Details
Main Authors:	Megías, Alberto, Arredondo, Sergio Contreras, Chen, Cheng Giuseppe, Tang, Chenyu, Roux, Benoît, Chipot, Christophe
Format:	Preprint
Published:	2024
Subjects:	Computational Physics Statistical Mechanics Data Analysis, Statistics and Probability
Online Access:	Acceder al recurso
Tags:	Add Tag No Tags, Be the first to tag this record!

Similar Items

From Atoms to Dynamics: Learning the Committor Without Collective Variables
by: Arredondo, Sergio Contreras, et al.
Published: (2025)

Following the Committor Flow: A Data-Driven Discovery of Transition Pathways
by: Chen, Cheng Giuseppe, et al.
Published: (2025)

An exact multiple-time-step variational formulation for the committor and the transition rate
by: Lorpaiboon, Chatipat, et al.
Published: (2025)

Sliding down the stairs: how correlated latent variables accelerate learning with neural networks
by: Bardone, Lorenzo, et al.
Published: (2024)

Similarity networks of ordinal-pattern transitions classify falling paper trajectories
by: Flores, Angelo A., et al.
Published: (2025)

Sampling the space of solutions of an artificial neural network
by: Zambon, Alessandro, et al.
Published: (2025)

From Static Pathways to Dynamic Mechanisms: A Committor-Based Data-Driven Approach to Chemical Reactions
by: Talmazan, Radu A., et al.
Published: (2025)

Physical networks as network-of-networks
by: Pete, Gábor, et al.
Published: (2023)

Entropy of spatial network with applications to non-extensive statistical mechanics
by: Kazemi, O. K., et al.
Published: (2025)

Deep learning of phase transitions with minimal examples
by: Abuali, Ahmed, et al.
Published: (2025)

A control variate method for threshold crossing probabilities of plastic deformation driven by transient coloured noise
by: Ip, Harry L. F., et al.
Published: (2025)

Phase transitions and departure statistics of critically loaded queues: oscillating cumulants and generalized BRAVO
by: Bruderer, Martin
Published: (2024)

Subleading-order theory for condensation transitions in large deviations of sums of independent and identically distributed random variables
by: Smith, Naftali R.
Published: (2025)

From high-dimensional committors to reactive insights
by: Strand, Nils E., et al.
Published: (2024)

Evanescent random walker on networks: Hitting times, budget renewal, and survival dynamics
by: Michelitsch, Thomas M., et al.
Published: (2025)

Graph theoretic derivation of mutual linearity for transient probabilities and hitting time distributions in Markov networks
by: Voits, Julian B., et al.
Published: (2026)

Occupation time of a system of Brownian particles on the line with steplike initial condition
by: Burenev, Ivan N., et al.
Published: (2023)

Additive-Functional Approach to Transport in Periodic and Tilted Periodic Potentials
by: Yang, Sang, et al.
Published: (2026)

Survival probability of random networks
by: Peralta-Martinez, Kevin, et al.
Published: (2026)

Maximum entropy for dynamic processes on networks
by: Abadi, Noam, et al.
Published: (2025)

Maximum entropy in dynamic complex networks
by: Abadi, Noam, et al.
Published: (2024)

Exact solution of three-point functions in critical loop models
by: Ang, Morris, et al.
Published: (2026)

Learning protein-ligand unbinding pathways via single-parameter community detection
by: Tänzel, Victor, et al.
Published: (2024)

Nearest neighbor permutation entropy detects phase transitions in complex high-pressure systems
by: Pessa, Arthur A. B., et al.
Published: (2025)

A discontinuous percolation phase transition on the hierarchical lattice
by: Bäumler, Johannes, et al.
Published: (2025)

Dynamically Emergent Correlations
by: Majumdar, Satya N., et al.
Published: (2026)

New insights into the distribution of the topmost gap in random walks and Lévy flights
by: Godrèche, Claude, et al.
Published: (2025)

Velocity trapping in the lifted TASEP and the true self-avoiding random walk
by: Massoulié, Brune, et al.
Published: (2025)

Mean-field limits in interacting particle systems with symmetric superlinear rates
by: Koutsimpela, Angeliki
Published: (2025)

Lévy walkers inside spherical shells with absorbing boundaries: Towards settling the optimal Lévy walk strategy for random searches
by: Caramês, L. G. P., et al.
Published: (2026)

Cost of excursions until first crossing of the origin for random walks and Lévy flights: an exact general formula
by: Mori, Francesco, et al.
Published: (2024)

Renewal theory for a run-and-tumble particle with stochastic resetting and a sticky boundary
by: Bressloff, Paul C, et al.
Published: (2026)

Upper bounds for the connective constant of weighted self-avoiding walks
by: He, Qidong
Published: (2025)

Activated random walk exhibits self-organized criticality
by: Hoffman, Christopher, et al.
Published: (2026)

Aging Record Statistics in Saturating Self-Interacting Random Walks
by: Brémont, J., et al.
Published: (2026)

Two-dimensional fractional Brownian motion: Analysis in time and frequency domains
by: Balcerek, Michał, et al.
Published: (2025)

Mean first passage times of higher-dimensional velocity jump processes
by: D'Orsogna, Maria R., et al.
Published: (2026)

Classification of diffusion processes in dimension $d$ via the Carleman approach with applications to models involving additive, multiplicative or square-root noises
by: Monthus, Cecile
Published: (2025)

Martingale drift of Langevin dynamics and classical canonical spin statistics
by: Sekimoto, Ken
Published: (2023)

Large deviations for trajectory observables of diffusion processes in dimension $d>1$ in the double limit of large time and small diffusion coefficient
by: Monthus, Cecile
Published: (2023)