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atomistic-machine-learning

@atomistic-machine-learning

Selected public research from this GitHub organization.

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github · 2026-09-22

Sources & versions

atomistic-machine-learning/schnetpack
Reference role
primary
Last successful public check
2026-09-22T08:38:14.276Z
Latest public check attempt
2026-09-22T08:38:14.276Z · ok
GitHub metrics
Stars 941 · checked · latest attempt 2026-09-22T08:38:14.276Z (ok)
Forks 251 · checked · latest attempt 2026-09-22T08:38:14.276Z (ok)
Latest default-branch commit
Unknown
Source activity check
missing · last successful check unknown · latest attempt 2026-09-22T08:38:14.276Z (unavailable)
Source status
Active at last observation
License
Unknown — check the source terms
Fixed commit
Not available

Default-branch activity is separate from the fixed reference above. Source terms apply. A fixed commit identifies content; it does not establish scientific validity.

Related research

License unknown

Tool

SchNetPack tool

Build and train atomistic neural networks to predict molecular or material potential-energy surfaces and related properties.

Added Change observed by
GitHub · atomistic-machine-learning/schnetpackStars 941Forks 251
Chemical sciences
SchNetPackCommunity indexed

Build and train atomistic neural networks to predict molecular or material potential-energy surfaces and related properties.

Research discipline Chemical sciences · Physical sciencesReusable outputs 1
Added Change observed by
GitHub · atomistic-machine-learning/schnetpackStars 941Forks 251

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