Skip to content

Pull requests: MolSSI/QCElemental

Author
Filter by author
Loading
Label
Filter by label
Loading
Use alt + click/return to exclude labels
or + click/return for logical OR
Projects
Filter by project
Loading
Milestones
Filter by milestone
Loading
Reviews
Assignee
Filter by who’s assigned
Sort

Pull requests list

further which patching for py312
#329 by loriab was merged Oct 26, 2023 Loading…
2 tasks done
reset black to 2022
#320 by loriab was merged Sep 29, 2023 Loading…
2 tasks
Feature devops moderization
#309 by coltonbh was closed Mar 28, 2023 Loading…
2 tasks
update after pint v0.20 rearrangement
#297 by loriab was merged Oct 31, 2022 Loading…
2 tasks done
Update for Pint 0.20 API breaks
#296 by mattwthompson was closed Oct 31, 2022 Loading…
2 tasks done
v0.25 changelog
#292 by loriab was merged Jun 13, 2022 Loading…
2 tasks done
Add t-amplitude driver to DriverEnum
#284 by cgbriggs99 was closed Dec 7, 2021 Loading…
2 tasks
collect qcschema samples
#280 by loriab was merged Sep 23, 2021 Loading…
2 tasks done
try pushing docs only from master
#279 by loriab was merged Sep 21, 2021 Loading…
Update docs-cf.yaml
#278 by loriab was merged Sep 21, 2021 Loading…
after psi v1.4
#269 by loriab was closed Aug 24, 2021 Loading…
2 tasks
Extending serialization wontfix This will not be worked on
#255 by anabiman was closed Mar 29, 2023 Loading…
1 of 2 tasks
dummy to check tests
#240 by loriab was closed Sep 18, 2020 Loading…
2 tasks
Schemalint3
#236 by loriab was closed Sep 4, 2020 Loading…
qcschema generating, testing, and reconciliation
#235 by loriab was closed Sep 4, 2020 Loading…
1 of 2 tasks
provenance default for schema
#233 by loriab was closed Sep 4, 2020 Loading…
5 tasks done
test lint
#224 by loriab was closed May 7, 2020 Loading…
GitHub Action btwn QCEl and QCSk
#218 by loriab was closed Sep 4, 2020 Loading…
2 tasks
GHA compare to QCSk
#204 by loriab was closed Mar 3, 2020 Loading…
2 tasks
Models: Force skip defaults for protocols Enhancement Project enhancement discussion
#141 by dgasmith was merged Sep 30, 2019 Loading…
data for vdW params
#111 by loriab was closed Sep 10, 2019 Loading…
Update Change Log for 0.5.0
#80 by Lnaden was merged Jul 17, 2019 Loading…
Periodic Table Docs Documentation Unclear or incorrect documentation
#46 by dgasmith was merged Mar 8, 2019 Loading…
Update from_schema.py
#21 by loriab was merged Jan 27, 2019 Loading…
Docs: Patches build failures by using conda-env/base.yaml for build Bug Code execution error
#19 by dgasmith was closed Jan 25, 2019 Loading…
ProTip! Filter pull requests by the default branch with base:master.