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LES extension (dipole, quadrupoles, polarizability, etc.) merge clean unit tests #1038: Pull request #1478 opened by djkim-kr
Action required ChengUCB:les_extension-merge-clean
ChengUCB:les_extension-merge-clean
Action required
LES extension (dipole, quadrupoles, polarizability, etc.) merge clean Pre-Commit Checks #1013: Pull request #1478 opened by djkim-kr
Action required ChengUCB:les_extension-merge-clean
ChengUCB:les_extension-merge-clean
Action required
Fix dataset content logging to count labels, not sum weights Pre-Commit Checks #1012: Pull request #1477 opened by vue1999
3m 8s vue1999:logging
vue1999:logging
3m 8s
Fix dataset content logging to count labels, not sum weights unit tests #1037: Pull request #1477 opened by vue1999
22m 7s vue1999:logging
vue1999:logging
22m 7s
Fix types.MethodType of cueq_conv_fusion with CueqConvFusionWrapper for LAMMPS compatibility unit tests #1036: Pull request #1475 opened by malixian
Action required malixian:fix-cueq-conv-fusion
malixian:fix-cueq-conv-fusion
Action required
Fix types.MethodType of cueq_conv_fusion with CueqConvFusionWrapper for LAMMPS compatibility Pre-Commit Checks #1011: Pull request #1475 opened by malixian
Action required malixian:fix-cueq-conv-fusion
malixian:fix-cueq-conv-fusion
Action required
Fix non-periodic cell inflation causing PolarMACE k-space OOM Pre-Commit Checks #1010: Pull request #1473 opened by samblau
Action required samblau:cell_fix
samblau:cell_fix
Action required
Fix non-periodic cell inflation causing PolarMACE k-space OOM unit tests #1035: Pull request #1473 opened by samblau
Action required samblau:cell_fix
samblau:cell_fix
Action required
Only plot head-specific test set in results for multihead models Pre-Commit Checks #1009: Pull request #1445 synchronize by joehart2001
9m 41s joehart2001:multihead-eval
joehart2001:multihead-eval
9m 41s
Only plot head-specific test set in results for multihead models unit tests #1034: Pull request #1445 synchronize by joehart2001
25m 5s joehart2001:multihead-eval
joehart2001:multihead-eval
25m 5s
Fine tuning with additional arbitrary embeddings. unit tests #1033: Pull request #1420 synchronize by williamdavie
Action required williamdavie:fine-tune-embeddings
williamdavie:fine-tune-embeddings
Action required
Fine tuning with additional arbitrary embeddings. Pre-Commit Checks #1008: Pull request #1420 synchronize by williamdavie
Action required williamdavie:fine-tune-embeddings
williamdavie:fine-tune-embeddings
Action required
Adding a MACE-MDP foundation model calculator and supporting cueq=True for AtomicDielectricMACE unit tests #1032: Pull request #1439 synchronize by Nilsgoe
21m 36s Nilsgoe:main
Nilsgoe:main
21m 36s
Adding a MACE-MDP foundation model calculator and supporting cueq=True for AtomicDielectricMACE Pre-Commit Checks #1007: Pull request #1439 synchronize by Nilsgoe
3m 10s Nilsgoe:main
Nilsgoe:main
3m 10s
Fine tuning with additional arbitrary embeddings. unit tests #1031: Pull request #1420 synchronize by williamdavie
Action required williamdavie:fine-tune-embeddings
williamdavie:fine-tune-embeddings
Action required
Fine tuning with additional arbitrary embeddings. Pre-Commit Checks #1006: Pull request #1420 synchronize by williamdavie
Action required williamdavie:fine-tune-embeddings
williamdavie:fine-tune-embeddings
Action required
CI tooling speedup. Tests #32: Pull request #1378 synchronize by CompRhys
20m 48s CompRhys:main
CompRhys:main
20m 48s
CI tooling speedup. Linting #28: Pull request #1378 synchronize by CompRhys
1m 26s CompRhys:main
CompRhys:main
1m 26s
Merge pull request #1468 from ACEsuit/develop Release on tag #12: Commit 4d2da09 pushed by ilyes319
50s v0.3.16
v0.3.16
50s
Robust polarizability output (try _sh first, list keys if missing) Diagnose mh-1 cueq parity (issue #10: Commit 1c24202 pushed by ilyes319
4m 2s diagnose-1469
diagnose-1469
4m 2s
Print polarizability raveled (avoid trace on non-square shape) Diagnose mh-1 cueq parity (issue #9: Commit b731847 pushed by ilyes319
4m 1s diagnose-1469
diagnose-1469
4m 1s
Read polar outputs from calc.results dict, not get_property Diagnose mh-1 cueq parity (issue #8: Commit 05f7e56 pushed by ilyes319
4m 8s diagnose-1469
diagnose-1469
4m 8s
Install graph_longrange to enable PolarMACE loading Diagnose mh-1 cueq parity (issue #7: Commit bc91ec8 pushed by ilyes319
4m 2s diagnose-1469
diagnose-1469
4m 2s
Merge pull request #1468 from ACEsuit/develop unit tests #1030: Commit 4d2da09 pushed by ilyes319
24m 29s main
main
24m 29s
Merge pull request #1468 from ACEsuit/develop Pre-Commit Checks #1005: Commit 4d2da09 pushed by ilyes319
10m 10s main
main
10m 10s