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Package Details: python-qcelemental 0.28.0-2
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Git Clone URL: | https://aur.archlinux.org/python-qcelemental.git (read-only, click to copy) |
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Package Base: | python-qcelemental |
Description: | Periodic table, physical constants, and molecule parsing for quantum chemistry |
Upstream URL: | https://docs.qcarchive.molssi.org/projects/qcelemental/en/latest/ |
Licenses: | MIT |
Submitter: | berquist |
Maintainer: | berquist |
Last Packager: | berquist |
Votes: | 0 |
Popularity: | 0.000000 |
First Submitted: | 2019-10-26 20:41 (UTC) |
Last Updated: | 2024-08-27 02:12 (UTC) |
Dependencies (9)
- python-numpy (python-numpy-flameAUR, python-numpy-gitAUR, python-numpy1AUR, python-numpy-mkl-tbbAUR, python-numpy-mklAUR, python-numpy-mkl-binAUR)
- python-pint
- python-pydantic (python-pydantic-gitAUR)
- python-build (make)
- python-installer (python-installer-gitAUR) (make)
- python-poetry (python-poetry-gitAUR) (make)
- python-wheel (make)
- python-pytest (check)
- python-networkx (python-networkx-gitAUR) (optional)
Latest Comments
berquist commented on 2024-11-01 01:21 (UTC)
Yep, I can test fine with
makepkg -sf
but not in a chroot...jahway603 commented on 2024-10-31 23:49 (UTC)
Having trouble building this package. Complete error log is located here for your review & suggestions: https://bin.linux.pizza/?952b99f1eff9dbba#FWUJsXgvMKeXpiDrZUjEMHfj6bMXaiJk2iMswbch4Na9
banana-bred commented on 2023-08-21 18:10 (UTC)
Thanks for packaging this. It builds, but only if I disable the checksum test and the check() function, i.e.
makepkg -si --skipchecksum --nocheck
,so I'm not yet sure that everything built properly.
Also, version 0.26.0 is out : https://pypi.org/project/qcelemental/0.26.0/
Tenshi65535 commented on 2022-12-15 10:51 (UTC)
Hello berquist, would you like to update this package to v0.25.1? It is available now:https://github.com/MolSSI/qcelemental/archive/v0.25.1.tar.gz
Also please update the upstream url as well.
berquist commented on 2020-04-26 01:18 (UTC)
Gemini commented on 2020-04-05 18:18 (UTC)
Hello, couple things:
1) python-pint is not AUR and the installer complains it cannot be found. I've installed manually, as per usual pacman, and it stopped complaining. So it should have found it;
2) Trying to install python-pydantic failed, I posted to their maintainers, i know it's not your responsibility but how did you do it, manually git? Anyway, I'll report back if this solves everything.
thanks.
hcar commented on 2020-04-04 06:41 (UTC)
The checksum test fails.