aiidateam aiida-workgraph issues

aiidateam / aiida-workgraph

Efficiently design and manage flexible workflows with AiiDA, featuring an interactive GUI, checkpoints, provenance tracking, and remote execution capabilities.

https://aiida-workgraph.readthedocs.io/en/latest/

MIT License

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issues

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Pass `Socket` in to a dynamic namespace raise an error

#362 superstar54 opened 3 hours ago
0
WorkGraph wait should give a warning when timeout

#361 superstar54 opened 6 hours ago
0
Name bikeshedding 👀 `set_future_context`?

#360 GeigerJ2 opened 5 days ago
0
Rename `set_context` on a `Task` to `to_context`?

#359 GeigerJ2 opened 5 days ago
0
`set_context` on `WorkGraph`, not on `Task`?

#358 GeigerJ2 opened 5 days ago
0
Swap key and value for `set_context`

#357 GeigerJ2 opened 5 days ago
0
Support creating tasks from builders

#356 GeigerJ2 opened 5 days ago
0
the identifier of the output type `aiida.orm.StructureData` is not 'workgraph.aiida_structuredata` but `StructureData`

#355 rikigigi opened 5 days ago
0
Should we expose decorators at the package top-level?

#354 GeigerJ2 opened 6 days ago
0
Dev: Cleanup before stable release

#353 GeigerJ2 opened 6 days ago
0
bump node-graph to 0.1.2

#352 superstar54 closed 6 days ago
1
Avoid passing `None` to arguments of `prepare_shell_job_inputs`

#351 GeigerJ2 closed 1 week ago
0
Update root property in the case of nest namespace

#350 superstar54 closed 5 days ago
1
Make `"name"` specifier of `parser_outputs` optional

#349 GeigerJ2 closed 1 week ago
0
Capture `ValueError` from `aiida-shell` for non-existing executable

#348 GeigerJ2 closed 1 week ago
0
Visualize `nodes` inputs for ShellJob tasks

#347 GeigerJ2 closed 1 week ago
0
Hide metadata inputs for tasks in HTML visualization.

#346 GeigerJ2 opened 1 week ago
3
Allow mixed `str`/`dict` inputs/outputs to tasks

#345 GeigerJ2 opened 1 week ago
1
Add .vscode directory to gitignore

#344 GeigerJ2 closed 1 week ago
0
Pass list of names for task input/output directly

#343 GeigerJ2 closed 1 week ago
0
`circular import` in task pool

#342 superstar54 closed 6 days ago
3
Set the default value of the namespace socket to None

#341 superstar54 closed 3 weeks ago
1
Prune empty dict before submit process

#340 superstar54 opened 3 weeks ago
0
Add _wait Socket for Context Transitions and Fix Allowed Types for AiiDA Property

#339 superstar54 closed 3 weeks ago
1
Support store_provenance in normal task

#338 superstar54 opened 1 month ago
0
Move PythonJob outside

#337 superstar54 opened 1 month ago
0
Fix recursive workgraph

#336 superstar54 opened 2 months ago
1
Use group_inputs and group_outputs when creating Task

#335 superstar54 closed 2 months ago
1
Add doc howto: Recursive workflows with Graph Builder

#334 agoscinski opened 2 months ago
1
Recursive WorkGraph with Graph Builder can only be run for the amount of redefinition of it

#333 agoscinski opened 2 months ago
3
Refactor visualization of graph in Web App, Widget and HTML template

#332 superstar54 opened 2 months ago
0
add padding for scope

#331 superstar54 closed 2 months ago
2
Update task's outputs if the corresponding node is finished ok

#330 superstar54 closed 2 months ago
1
Building the docs locally adds lots of noise for version control

#329 GeigerJ2 opened 2 months ago
2
Allow passing [] and {} as argument.

#328 superstar54 closed 2 months ago
1
Zone: should avoid multiple parent zone.

#327 superstar54 opened 2 months ago
0
Update parser signature for `aiida-shell` v0.8, extend ShellJob docs, use `prepare_shell_job_inputs`

#326 GeigerJ2 closed 2 months ago
2
Removing QE dependencies and tutorials

#325 agoscinski opened 2 months ago
4
Improve test coverage

#324 superstar54 opened 2 months ago
0
Improve the docs

#323 superstar54 opened 2 months ago
0
Add and standardize the docstring

#322 superstar54 opened 2 months ago
0
Clean unused code in the Web App

#321 superstar54 opened 2 months ago
0
Improve error message for all

#320 superstar54 opened 2 months ago
0
Add type annotation for all

#319 superstar54 opened 2 months ago
0
Link limit is wrong for the kwargs of a calcfunction task

#318 superstar54 opened 2 months ago
0
Set the default value to an empty dictionary for namespace socket

#317 superstar54 closed 2 months ago
1
Support latest aiida-shell 0.8.0

#316 superstar54 closed 2 months ago
3
ShellJob: convert `argument` when it is a string.

#315 superstar54 closed 2 months ago
4
Docs/ShellJob: Using a pre-configured code

#314 superstar54 closed 2 months ago
1
Be careful on the inputs of the `graph_builder` task.

#313 superstar54 opened 2 months ago
0