aiidateam/aiida-workgraph

Issues

• Support creating tasks from builders

  #356 opened 2 months ago by GeigerJ2
  5

• Validate the inputs

  #385 opened a month ago by superstar54
  0

• Save pickled data into repository

  #382 opened a month ago by superstar54
  0

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

  #362 opened a month ago by superstar54
  0

• Allow developer define their own `type_mapping` for their sockets

  #379 opened a month ago by superstar54
  0

• Clean unused code in the Web App

  #321 opened a month ago by superstar54
  0

• Mapping or parity between WG UUIDs and `aiida-core` UUIDs

  #365 opened 2 months ago by GeigerJ2
  1

• Improve test coverage

  #324 opened a month ago by superstar54
  0

• Move PythonJob outside

  #337 opened a month ago by superstar54
  0

• Swap key and value for `set_context`

  #357 opened a month ago by GeigerJ2
  0

• Hook to update input sockets of many tasks coordinately

  #370 opened a month ago by superstar54
  0

• Refactor the engine

  #368 opened a month ago by superstar54
  0

• WorkGraph wait should give a warning when timeout

  #361 opened 2 months ago by superstar54
  0

• Name bikeshedding 👀 `set_future_context`?

  #360 opened 2 months ago by GeigerJ2
  0

• `set_context` on `WorkGraph`, not on `Task`?

  #358 opened 2 months ago by GeigerJ2
  0

• Rename `set_context` on a `Task` to `to_context`?

  #359 opened 2 months ago by GeigerJ2
  0

• Should we expose decorators at the package top-level?

  #354 opened 2 months ago by GeigerJ2
  0

• the identifier of the output type `aiida.orm.StructureData` is not 'workgraph.aiida_structuredata` but `StructureData`

  #355 opened 2 months ago by rikigigi
  0

• `circular import` in task pool

  #342 opened 2 months ago by superstar54
  3

• Dev: Cleanup before stable release

  #353 opened 2 months ago by GeigerJ2
  0

• Capture `ValueError` from `aiida-shell` for non-existing executable

  #348 opened 2 months ago by GeigerJ2
  0

• Add type annotation for all

  #319 opened 4 months ago by superstar54
  0

• GUI: show node properties (detail view)

  #296 opened 2 months ago by superstar54
  0

• Prune empty dict before submit process

  #340 opened 2 months ago by superstar54
  0

• Support store_provenance in normal task

  #338 opened 3 months ago by superstar54
  0

• Support latest aiida-shell 0.8.0

  #316 opened 4 months ago by superstar54
  3

• Docs/ShellJob: Using a pre-configured code

  #314 opened 4 months ago by superstar54
  1

• ShellJob: convert `argument` when it is a string.

  #315 opened 4 months ago by superstar54
  4

• Recursive WorkGraph with Graph Builder can only be run for the amount of redefinition of it

  #333 opened 4 months ago by agoscinski
  3

• Refactor visualization of graph in Web App, Widget and HTML template

  #332 opened 4 months ago by superstar54
  0

• Building the docs locally adds lots of noise for version control

  #329 opened 4 months ago by GeigerJ2
  2

• How to handle the Zone (while/if) task if any task inside the zone failed?

  #310 opened 4 months ago by superstar54
  0

• Zone: should avoid multiple parent zone.

  #327 opened 4 months ago by superstar54
  0

• Improve the docs

  #323 opened 4 months ago by superstar54
  0

• Add and standardize the docstring

  #322 opened 4 months ago by superstar54
  0

• Improve error message for all

  #320 opened 4 months ago by superstar54
  0

• Link limit is wrong for the kwargs of a calcfunction task

  #318 opened 4 months ago by superstar54
  0

• Be careful on the inputs of the `graph_builder` task.

  #313 opened 4 months ago by superstar54
  0

• Changing the name of `.value` for `SocketAny` to obtain AiiDA `Node`

  #293 opened 4 months ago by GeigerJ2
  5

• PythonJob serialize **kwargs as one Dict

  #307 opened 4 months ago by superstar54
  0

• Set `link_limit` for `var_kwargs` input 1e6

  #303 opened 4 months ago by superstar54
  0

• Support error_handler priority and check the result of error_handler

  #305 opened 4 months ago by superstar54
  0

• Supporting custom exit code for PythonJob.

  #301 opened 4 months ago by superstar54
  0

• Nested WorkGraph: Error in loading executor: a bytes-like object is required, not 'NoneType

  #285 opened 4 months ago by agoscinski
  0

• Setting computer in ShellJob raises pickle error

  #290 opened 4 months ago by agoscinski
  0

• Allow user to change background of GUI

  #286 opened 5 months ago by superstar54
  0

• Add documentation a notebook for aggregating dynamically sized inputs

  #284 opened 5 months ago by agoscinski
  0

• Stringly typed to strongly typed.

  #282 opened 5 months ago by superstar54
  0

• WorkGraph can not serialize the initial context

  #280 opened 5 months ago by superstar54
  0

• Moving quantum-espresso dependent examples to aiida-tutorials

  #278 opened 5 months ago by agoscinski
  0