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Pull requests: OpenFreeEnergy/alchemiscale

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Pull requests list

Use Pydantic v1 from v2 backdoor
#281 opened Jul 16, 2024 by mattwthompson • Draft
5
Implement task restart policies
#280 opened Jul 16, 2024 by ianmkenney Loading…
1
2
Add espaloma_charge and nagl
#274 opened May 7, 2024 by mikemhenry Loading…
1
Use diskcache for caching ProtocolDAGResults in the Alchemiscale client
#271 opened Apr 25, 2024 by ianmkenney Loading…
1
1
install latest openfe and gufe as a canary to catch upstream changes
#204 opened Nov 20, 2023 by mikemhenry Loading…
5
Use pydantic > 1
#192 opened Oct 12, 2023 by dotsdl Loading… Release 0.6.0 - result retrieval optimizations, server-side task restart policies
@dotsdl
4
[doc] docker compose plugin to newest version
#183 opened Sep 26, 2023 by mikemhenry • Draft
1
build and test all images, add apptainer
#170 opened Aug 23, 2023 by mikemhenry • Draft
2
bump to new version of sphinx
#169 opened Aug 22, 2023 by mikemhenry Loading…
7
[WIP] Adding TaskProvenance usage to compute execution and results
#114 opened Apr 4, 2023 by dotsdl Loading…
1
[WIP] Result path conversion and upload to object store
#104 opened Mar 24, 2023 by dotsdl Loading…
1
@dotsdl
1
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