Samuel Del Fré

Univ. Lille, CNRS, UMR 8523 – PhLAM – Physique des Lasers Atomes et Molécules, F-59000 Lille, France

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Publication activitypapers/week, last 8 weeks

Research focus

Data Curation & Synthetic Data (1)Scientific Discovery & Drug Design (1)

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Samuel Del Fr'e (1)Gilberto A. Alou Angulo (1)M. Monnerville (1)Maurice Monnerville (1)

Papers (1)

Mar 19, 2026

1w ago

Data-driven construction of machine-learning-based interatomic potentials for gas-surface scattering dynamics: the case of NO on graphite

Descriptor-guided sampling and active learning slashes the cost of simulating gas-surface interactions, enabling accurate molecular dynamics at scale.

Samuel Del Fré, Samuel Del Fr'e, Gilberto A. Alou Angulo +4

Data Curation & Synthetic Data Scientific Discovery & Drug Design

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Samuel Del Fré

Publication activitypapers/week, last 8 weeks

Research focus

Frequent co-authors

Papers (1)