Cover Image

Learning inducing points and uncertainty on molecular data by scalable variational Gaussian processes

Fuente: arXiv

Saved in:

Bibliographic Details
Main Authors:	Tsitsvero, Mikhail, Jin, Mingoo, Lyalin, Andrey
Format:	Preprint
Published:	2022
Subjects:	Chemical Physics Machine Learning Computational Physics 60G15, 60-08, 68-04, 68T99, 92E99
Online Access:	Acceder al recurso
Tags:	Add Tag No Tags, Be the first to tag this record!

Similar Items

Axiomatic Foundations of Chemical Systems as Ternary $Γ$-Semirings
by: Gokavarapu, Chandrasekhar, et al.
Published: (2025)

Chemical Systems as Ternary $Γ$-Semirings:Theory, Case Studies, and Operational Tests
by: Gokavarapu, Chandrasekhar, et al.
Published: (2025)

Lambda-Fleming-Viot processes arising in logistic Bienaymé-Galton-Watson processes with a large carrying capacity
by: Forien, Raphaël
Published: (2025)

A binary search scheme for determining all contaminated specimens
by: Papanicolaou, Vassilis G.
Published: (2020)

Exploring Non-Steady-State Charge Transport Dynamics in Information Processing: Insights from Reservoir Computing
by: Li, Zheyang, et al.
Published: (2023)

Non-asymptotic bounds for forward processes in denoising diffusions: Ornstein-Uhlenbeck is hard to beat
by: Brešar, Miha, et al.
Published: (2024)

The Spatial Regime Conversion Method
by: Cameron, Charles G., et al.
Published: (2025)

Convergence proofs and strong error bounds for forward-backward stochastic differential equations using neural network simulations
by: Sheridan-Methven, Oliver
Published: (2024)

Numerical Analysis of the Complete Active-Space Extended Koopmans's Theorem
by: Hemmati, Reza, et al.
Published: (2024)

Infinite-Dimensional Diffusion Models
by: Pidstrigach, Jakiw, et al.
Published: (2023)

SIR epidemics in populations with large sub-communities
by: Ball, Frank, et al.
Published: (2022)

Two waves of adaptation: speciation induced by dormancy in a model with changing environment
by: Cordero, Fernando, et al.
Published: (2024)

Time-adaptive functional Gaussian Process regression
by: Ruiz-Medina, MD, et al.
Published: (2026)

Local moduli of continuity for permanental processes that are zero at zero
by: Marcus, Michael B., et al.
Published: (2024)

Directional Gaussian hypergeometric beta distributions and their uses in contaminated binary sampling
by: O'Neill, Ben
Published: (2025)

Delay compartment models from a stochastic process
by: Angstmann, Christopher N., et al.
Published: (2024)

Spatial best linear unbiased prediction: A computational mathematics approach for high dimensional massive datasets
by: Castrillon-Candas, Julio E.
Published: (2017)

Extending choice assessments to choice functions: An algorithm for computing the natural extension
by: Decadt, Arne, et al.
Published: (2024)

Algorithmic information theory and martingales
by: Bienvenu, Laurent, et al.
Published: (2009)

On the number and size of Markov equivalence classes of random directed acyclic graphs
by: Schmid, Dominik, et al.
Published: (2022)

IntegralGP: Volumetric estimation of subterranean geochemical properties in mineral deposits by fusing assay data with different spatial supports
by: Chlingaryan, Anna, et al.
Published: (2025)

Evolving Local Corrections for Global Constructions in Combinatorics
by: Bérczi, Gergely
Published: (2026)

Persistence and extinction dynamics in a stochastic predator-prey model with emergent Allee effects
by: Granados, Carlos, et al.
Published: (2025)

Noncentral limit results for spatiotemporal random fields on manifolds and beyond
by: Ruiz-Medina, M. D.
Published: (2026)

Exploring Singularities in point clouds with the graph Laplacian: An explicit approach
by: Andersson, Martin, et al.
Published: (2022)

PTOPOFL: Privacy-Preserving Personalised Federated Learning via Persistent Homology
by: Vomo-Donfack, Kelly L, et al.
Published: (2026)

The Bunching and Monotonicity Properties of Families of Probability Distributions
by: Portnoy, S., et al.
Published: (2024)

Genetic Composition of Supercritical Branching Populations under Power Law Mutation Rates
by: Brouard, Vianney
Published: (2023)

Passage times of fast inhomogeneous immigration processes
by: Tung, Hwai-Ray, et al.
Published: (2025)

The degree-restricted random process is far from uniform
by: Molloy, Michael, et al.
Published: (2022)

Connectivity of random graphs after centrality-based vertex removal
by: Pandey, Manish, et al.
Published: (2023)

Delay Infectivity and Delay Recovery SIR model
by: Angstmann, Christopher N., et al.
Published: (2024)

First passage times with fast immigration
by: Tung, Hwai-Ray, et al.
Published: (2025)

Calibrated Explanations for Regression
by: Löfström, Tuwe, et al.
Published: (2023)

Empirically Exploring the Space of Monostationarity in Dual Phosphorylation
by: Cai, May, et al.
Published: (2024)

Learning collective variables that preserve transition rates
by: Sule, Shashank, et al.
Published: (2025)

On the Convergence of the ELBO to Entropy Sums
by: Lücke, Jörg, et al.
Published: (2022)

Generative Models with ELBOs Converging to Entropy Sums
by: Warnken, Jan, et al.
Published: (2024)

Incomplete Data Multi-Source Static Computed Tomography Reconstruction with Diffusion Priors and Implicit Neural Representation
by: Shen, Ziju, et al.
Published: (2025)

Molecular Weight Distribution Modeling in Step Growth Polymerization of Oligomers
by: Kondratov, Serhii
Published: (2024)