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cs.LG2023★ 9 cited
Insightful analysis of historical sources at scales beyond human capabilities using unsupervised Machine Learning and XAI
Oliver Eberle, Jochen Büttner, Hassan El-Hajj +3
Historical materials are abundant. Yet, piecing together how human knowledge has evolved and spread both diachronically and synchronically remains a challenge that can so far only…
physics.chem-ph2023★ 1 cited
From Peptides to Nanostructures: A Euclidean Transformer for Fast and Stable Machine Learned Force Fields
J. Thorben Frank, Oliver T. Unke, Klaus-Robert Müller +1
Recent years have seen vast progress in the development of machine learned force fields (MLFFs) based on ab-initio reference calculations. Despite achieving low test errors, the re…