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Pull requests: atomistic-machine-learning/schnetpack

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Pull requests list

updated lammps docs
#797 opened Aug 17, 2026 by jnsLs Collaborator Loading…
3
Batchwise optimizer performance improvements
#795 opened Aug 14, 2026 by jnsLs Collaborator • Draft
hydra search path bug bug Something isn't working
#794 opened Aug 14, 2026 by jnsLs Collaborator Loading…
1
Enhance ASEAtomsData with available properties caching
#792 opened Aug 12, 2026 by sundusaijaz Collaborator Loading…
fixed bug in dataset tests
#791 opened Aug 11, 2026 by jnsLs Collaborator Loading…
3
Jl/manifest
#790 opened Aug 10, 2026 by jnsLs Collaborator Loading…
2 tasks
6
EMA Checkpoint Fix
#789 opened Jul 28, 2026 by sundusaijaz Collaborator Loading…
Bug-Fix: Fallback to empty dict when metrics=None in ModelOutput
#782 opened Feb 23, 2026 by rush42 Contributor Loading…
MPTraj Data Class & Config
#773 opened Dec 23, 2025 by sundusaijaz Collaborator Loading…
use numerical stability parameter for calculatiung d_ij
#739 opened Jun 24, 2025 by stefaanhessmann Collaborator • Draft
3
Matbench Discovery Challenge
#729 opened May 27, 2025 by sundusaijaz Collaborator • Draft
@sundusaijaz
11
Ep/bernstein adaptive loss
#667 opened Oct 24, 2024 by epens94 Collaborator Loading…
ProTip! What’s not been updated in a month: updated:<2026-07-20.