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creating example of single reftraj calculation Continuous Integration #452: Commit fda7e49 pushed by cpignedoli
February 11, 2024 09:06 3m 32s feature/traj-input
feature/traj-input
February 11, 2024 09:06 3m 32s
Implement support for the REFTRAJ simpulation Continuous Integration #451: Pull request #207 synchronize by cpignedoli
February 10, 2024 16:47 10m 28s feature/traj-input
feature/traj-input
February 10, 2024 16:47 10m 28s
EXT_RESTART section Continuous Integration #450: Commit 1540a4c pushed by cpignedoli
February 10, 2024 16:47 9m 51s feature/traj-input
feature/traj-input
February 10, 2024 16:47 9m 51s
Implement support for the REFTRAJ simpulation Continuous Integration #449: Pull request #207 opened by cpignedoli
February 10, 2024 15:00 10m 10s feature/traj-input
feature/traj-input
February 10, 2024 15:00 10m 10s
preliminary version of input trajectory in cp2k plugin Continuous Integration #448: Commit 54f176c pushed by cpignedoli
February 10, 2024 14:59 10m 8s feature/traj-input
feature/traj-input
February 10, 2024 14:59 10m 8s
Implement trajectory parser, provide example of MD simulations (#206) Continuous Integration #447: Commit 01564a7 pushed by yakutovicha
February 8, 2024 15:59 10m 26s main
main
February 8, 2024 15:59 10m 26s
Implement trajectory parser, provide example of MD simulations. Continuous Integration #446: Pull request #206 synchronize by yakutovicha
February 7, 2024 15:06 10m 16s feature/trajectory-parser
feature/trajectory-parser
February 7, 2024 15:06 10m 16s
Add more logic to the trajectory parser. Continuous Integration #445: Commit 30805ca pushed by yakutovicha
February 7, 2024 15:06 10m 14s feature/trajectory-parser
feature/trajectory-parser
February 7, 2024 15:06 10m 14s
Implement trajectory parser, provide example of MD simulations. Continuous Integration #444: Pull request #206 synchronize by yakutovicha
February 7, 2024 14:38 9m 29s feature/trajectory-parser
feature/trajectory-parser
February 7, 2024 14:38 9m 29s
Add logic to parse trajectory only if last_structure is parsed. Continuous Integration #443: Commit 7dd201a pushed by yakutovicha
February 7, 2024 14:38 9m 13s feature/trajectory-parser
feature/trajectory-parser
February 7, 2024 14:38 9m 13s
Implement trajectory parser, provide example of MD simulations. Continuous Integration #442: Pull request #206 synchronize by yakutovicha
February 7, 2024 14:29 9m 24s feature/trajectory-parser
feature/trajectory-parser
February 7, 2024 14:29 9m 24s
Merge branch 'feature/trajectory-parser' of https://github.com/aiidat… Continuous Integration #441: Commit afd8e5d pushed by yakutovicha
February 7, 2024 14:29 9m 18s feature/trajectory-parser
feature/trajectory-parser
February 7, 2024 14:29 9m 18s
Implement trajectory parser, provide example of MD simulations. Continuous Integration #440: Pull request #206 synchronize by pre-commit-ci bot
February 7, 2024 14:20 9m 50s feature/trajectory-parser
feature/trajectory-parser
February 7, 2024 14:20 9m 50s
[pre-commit.ci] auto fixes from pre-commit.com hooks Continuous Integration #439: Commit eac4f0c pushed by pre-commit-ci bot
February 7, 2024 14:20 9m 54s feature/trajectory-parser
feature/trajectory-parser
February 7, 2024 14:20 9m 54s
Implement trajectory parser, provide example of MD simulations. Continuous Integration #438: Pull request #206 opened by yakutovicha
February 7, 2024 14:20 9m 20s feature/trajectory-parser
feature/trajectory-parser
February 7, 2024 14:20 9m 20s
Implement trajectory parser, provide example of MD simulations. Continuous Integration #437: Commit bd7a889 pushed by yakutovicha
February 7, 2024 14:20 9m 13s feature/trajectory-parser
feature/trajectory-parser
February 7, 2024 14:20 9m 13s
Fix: retrieve the last structure even if a calculation has failed (#205) Continuous Integration #436: Commit 0d2d3b6 pushed by yakutovicha
January 31, 2024 10:18 9m 50s main
main
January 31, 2024 10:18 9m 50s
Fix: retrieve the last structure even if the calculation has failed. Continuous Integration #435: Pull request #205 synchronize by yakutovicha
January 31, 2024 10:07 9m 31s fix/retrieve_final_structure_if_calculation_failed
fix/retrieve_final_structure_if_calculation_failed
January 31, 2024 10:07 9m 31s
Example_restart: add messages to the asserts. Continuous Integration #434: Commit e87f38b pushed by yakutovicha
January 31, 2024 10:07 10m 10s fix/retrieve_final_structure_if_calculation_failed
fix/retrieve_final_structure_if_calculation_failed
January 31, 2024 10:07 10m 10s
Fix: retrieve the last structure even if the calculation has failed. Continuous Integration #433: Pull request #205 synchronize by yakutovicha
January 31, 2024 10:01 9m 38s fix/retrieve_final_structure_if_calculation_failed
fix/retrieve_final_structure_if_calculation_failed
January 31, 2024 10:01 9m 38s
Fixing the parser. Continuous Integration #432: Commit 081c523 pushed by yakutovicha
January 31, 2024 10:01 9m 56s fix/retrieve_final_structure_if_calculation_failed
fix/retrieve_final_structure_if_calculation_failed
January 31, 2024 10:01 9m 56s
Fix: retrieve the last structure even if the calculation has failed. Continuous Integration #431: Pull request #205 opened by yakutovicha
January 31, 2024 09:44 8m 42s fix/retrieve_final_structure_if_calculation_failed
fix/retrieve_final_structure_if_calculation_failed
January 31, 2024 09:44 8m 42s
Fix: retrieve the last structure even if the calculation has failed. Continuous Integration #430: Commit 867b4de pushed by yakutovicha
January 31, 2024 09:44 8m 45s fix/retrieve_final_structure_if_calculation_failed
fix/retrieve_final_structure_if_calculation_failed
January 31, 2024 09:44 8m 45s
[pre-commit.ci] pre-commit autoupdate Continuous Integration #429: Pull request #204 synchronize by yakutovicha
January 5, 2024 09:37 1m 30s pre-commit-ci-update-config
pre-commit-ci-update-config
January 5, 2024 09:37 1m 30s
Update Python in the CI. Continuous Integration #428: Commit 882789a pushed by yakutovicha
January 5, 2024 09:36 1m 38s pre-commit-ci-update-config
pre-commit-ci-update-config
January 5, 2024 09:36 1m 38s