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feat(pt): train with energy Hessian
Build and upload to PyPI #10270: Pull request #4169 synchronize by 1azyking
November 23, 2024 12:15 Action required 1azyking:enerhess
November 23, 2024 12:15 Action required
merge master to devel (v3.0.0)
Build and upload to PyPI #10269: Pull request #4410 opened by njzjz
November 23, 2024 11:08 20m 9s njzjz:master-v3.0.0
November 23, 2024 11:08 20m 9s
merge devel to master (v3.0.0) (#4407)
Build and upload to PyPI #10268: Commit e695a91 pushed by njzjz
November 23, 2024 08:10 1h 45m 19s v3.0.0
November 23, 2024 08:10 1h 45m 19s
merge devel to master (v3.0.0) (#4407)
Build and upload to PyPI #10265: Commit e695a91 pushed by njzjz
November 23, 2024 07:56 1h 35m 36s master
November 23, 2024 07:56 1h 35m 36s
merge devel to master (v3.0.0)
Build and upload to PyPI #10264: Pull request #4407 opened by njzjz
November 23, 2024 06:46 55m 48s njzjz:devel-3.0.0
November 23, 2024 06:46 55m 48s
fix(pt): optimize createNlistTensor (#4403)
Build and upload to PyPI #10263: Commit 2303ff0 pushed by github-merge-queue bot
November 23, 2024 06:39 59m 12s devel
November 23, 2024 06:39 59m 12s
fix: add numb_fparam & numb_aparam to dipole & polar fitting (#4405)
Build and upload to PyPI #10262: Commit 2ce3276 pushed by github-merge-queue bot
November 23, 2024 04:49 34m 31s devel
November 23, 2024 04:49 34m 31s
fix(pt): use eval mode in the Python interface (#4404)
Build and upload to PyPI #10261: Commit d38c398 pushed by github-merge-queue bot
November 23, 2024 04:35 14m 43s devel
November 23, 2024 04:35 14m 43s
Build and upload to PyPI
Build and upload to PyPI #10260: Merge group checks requested
November 23, 2024 04:04 30m 30s
November 23, 2024 04:04 30m 30s
fix(pt/dp): make strip more efficient (#4400)
Build and upload to PyPI #10259: Commit 5d589da pushed by github-merge-queue bot
November 23, 2024 02:46 41m 56s devel
November 23, 2024 02:46 41m 56s
Build and upload to PyPI
Build and upload to PyPI #10258: Merge group checks requested
November 23, 2024 00:42 2h 28m 16s
November 23, 2024 00:42 2h 28m 16s
Build and upload to PyPI
Build and upload to PyPI #10257: Merge group checks requested
November 23, 2024 00:41 2h 28m 39s
November 23, 2024 00:41 2h 28m 39s
Build and upload to PyPI
Build and upload to PyPI #10256: Merge group checks requested
November 23, 2024 00:38 2h 32m 35s
November 23, 2024 00:38 2h 32m 35s
Build and upload to PyPI
Build and upload to PyPI #10255: Merge group checks requested
November 23, 2024 00:32 2h 11m 0s
November 23, 2024 00:32 2h 11m 0s
Build and upload to PyPI
Build and upload to PyPI #10254: Merge group checks requested
November 23, 2024 00:32 2h 11m 0s
November 23, 2024 00:32 2h 11m 0s
chore: use xp.take_along_axis if Array API version >=2024.12
Build and upload to PyPI #10253: Pull request #4406 opened by njzjz
November 22, 2024 23:43 17m 10s njzjz:xp-take-along-axis
November 22, 2024 23:43 17m 10s
fix: add numb_fparam & numb_aparam to dipole & polar fitting
Build and upload to PyPI #10252: Pull request #4405 synchronize by njzjz
November 22, 2024 21:28 18m 24s njzjz:dipole-polar-fparam-aparam
November 22, 2024 21:28 18m 24s
fix: add numb_fparam & numb_aparam to dipole & polar fitting
Build and upload to PyPI #10251: Pull request #4405 opened by njzjz
November 22, 2024 21:25 3m 1s njzjz:dipole-polar-fparam-aparam
November 22, 2024 21:25 3m 1s
fix(pt): use eval mode in the Python interface
Build and upload to PyPI #10250: Pull request #4404 opened by njzjz
November 22, 2024 19:37 34m 17s njzjz:pt-py-eval
November 22, 2024 19:37 34m 17s
fix(pt): use eval mode in the C++ interface
Build and upload to PyPI #10249: Pull request #4402 synchronize by njzjz
November 22, 2024 19:18 18m 45s njzjz:pt-cxx-eval
November 22, 2024 19:18 18m 45s
fix(pt): use eval mode in the C++ interface
Build and upload to PyPI #10248: Pull request #4402 synchronize by pre-commit-ci bot
November 22, 2024 18:59 19m 54s njzjz:pt-cxx-eval
November 22, 2024 18:59 19m 54s
fix(pt): use eval mode in the C++ interface
Build and upload to PyPI #10247: Pull request #4402 synchronize by njzjz
November 22, 2024 18:58 1m 51s njzjz:pt-cxx-eval
November 22, 2024 18:58 1m 51s
Fix: always output weighted average error (#4401)
Build and upload to PyPI #10246: Commit 7bd2e5a pushed by github-merge-queue bot
November 22, 2024 11:44 27m 49s devel
November 22, 2024 11:44 27m 49s