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Pull requests: facebookresearch/fairchem

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Pull requests list

Fairchem cpp cla signed enhancement New feature or request minor Minor version release
#1632 opened Nov 14, 2025 by misko • Draft
Random rotation data augmentation cla signed enhancement New feature or request patch Patch version release
#1631 opened Nov 14, 2025 by misko Loading…
@wood-b
Early Partition and Parallel Graph Gen cla signed enhancement New feature or request minor Minor version release
#1630 opened Nov 14, 2025 by rayg1234 Loading…
Jupyterbook>2 changes cla signed documentation Improvements or additions to documentation patch Patch version release
#1627 opened Nov 12, 2025 by zulissimeta Loading…
1
Batch server unit cla signed enhancement New feature or request minor Minor version release
#1622 opened Nov 11, 2025 by lbluque • Draft
1 of 2 tasks
Add omol conserve from scratch yaml cla signed enhancement New feature or request patch Patch version release
#1611 opened Nov 4, 2025 by rayg1234 Loading…
Revise data access instructions for OMol25 dataset cla signed
#1601 opened Oct 30, 2025 by blaiszik Loading…
2
pip: bump lmdb from 1.7.3 to 1.7.5 cla signed dependencies Pull requests that update a dependency file do not merge patch Patch version release python Pull requests that update Python code
#1593 opened Oct 27, 2025 by dependabot bot Loading…
@misko @rayg1234
@lbluque @mshuaibii
3
pip: bump torch from 2.8.0 to 2.9.0 cla signed dependencies Pull requests that update a dependency file minor Minor version release python Pull requests that update Python code
#1576 opened Oct 20, 2025 by dependabot bot Loading…
@misko @rayg1234
@lbluque @mshuaibii
1
Add yaml template paths as parameters for UMA finetuning script cla signed stale
#1572 opened Oct 20, 2025 by steinmig Loading…
3
add local env details to log cla signed enhancement New feature or request patch Patch version release
#1552 opened Oct 7, 2025 by misko • Draft
add thread support to MOLE cla signed
#1550 opened Oct 7, 2025 by misko • Draft
Fastcsp updates cla signed enhancement New feature or request minor Minor version release patch Patch version release
#1544 opened Oct 2, 2025 by gvahe Loading…
Formation energy calculator cla signed enhancement New feature or request minor Minor version release
#1538 opened Sep 30, 2025 by lbluque Loading…
19
upgrade numpy/numba cla signed dependencies Pull requests that update a dependency file no-op
#1537 opened Sep 30, 2025 by lbluque Loading…
1
PBC graphgen v3 (v2++) cla signed
#1524 opened Sep 24, 2025 by misko • Draft
Update gp utils cla signed enhancement New feature or request minor Minor version release
#1507 opened Sep 22, 2025 by misko Loading…
cleanup stress code cla signed enhancement New feature or request patch Patch version release
#1501 opened Sep 19, 2025 by misko Loading…
Cleanup + GP speed up cla signed enhancement New feature or request minor Minor version release
#1484 opened Sep 12, 2025 by misko • Draft
Add optional start_method argument to _cli.py cla signed enhancement New feature or request patch Patch version release
#1476 opened Sep 9, 2025 by amorehead Loading…
10
[ WIP ] [ future work ] Optimize GNN checkpoints cla signed stale
#1468 opened Sep 8, 2025 by misko • Draft
1
Add ODAC deformation runner/reducer and benchmark dataset cla signed enhancement New feature or request minor Minor version release
#1461 opened Sep 1, 2025 by lbrabson Loading…
4
[BE] Add chirality and pmg vs internal graph test cla signed enhancement New feature or request no-op test unit tests
#1403 opened Aug 5, 2025 by gvahe Loading…
1
Draft PR to think through how shallow ensembles could be implemented cla signed enhancement New feature or request minor Minor version release
#1384 opened Jul 28, 2025 by zulissimeta • Draft
Add hessian calculation in calculator cla signed enhancement New feature or request minor Minor version release
#1361 opened Jul 14, 2025 by ericyuan00000 Loading…
24
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