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On-the-fly fine-tuning of foundational neural network potentials: a Bayesian neural network approach

Tim Rensmeyer; Denis Kramer; Oliver Niggemann

Published
Publisher
Royal Society of Chemistry (RSC)
Journal / collection
Digital Discovery
Research area
AI & compute
Source type
Journal article
DOI
10.1039/d5dd00392j

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Tim Rensmeyer; Denis Kramer; Oliver Niggemann. On-the-fly fine-tuning of foundational neural network potentials: a Bayesian neural network approach. Digital Discovery. 2026. https://doi.org/10.1039/d5dd00392j

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