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Jonas Lederer
ORCID
Publication Activity (10 Years)
Years Active: 2023-2023
Publications (10 Years): 2
Top Topics
Primary Care
Molecular Dynamics Simulations
Neural Network
Single Molecule
Top Venues
Physical chemistry chemical physics : PCCP
The Journal of chemical physics
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This page only lists publications with an associated author ORCID identifier.
Publications
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Kristof T Schütt
,
Stefaan S P Hessmann
,
Niklas W A Gebauer
,
Jonas Lederer
,
Michael Gastegger
SchNetPack 2.0: A neural network toolbox for atomistic machine learning.
The Journal of chemical physics
158 (14) (2023)
Jonas Lederer
,
Michael Gastegger
,
Kristof T Schütt
,
Michael C Kampffmeyer
,
Klaus-Robert Müller
,
Oliver T Unke
Automatic identification of chemical moieties.
Physical chemistry chemical physics : PCCP
(2023)