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Add AlchemiscaleClient.copy_network, .merge_networks, and .merge_scopes methods

component-statestore

component-user-api

component-user-client

Status: Open.

#221 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Jan 9, 2024

Add scopes-exclude config option for compute services

component-compute-api

component-compute-client

component-compute-service

component-statestore

Status: Open.

#222 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Jan 9, 2024

Expose ability to get stored tracebacks associated with a given Task

Status: Open.

#347 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Jan 3, 2025

Set Task to error upon failure to create a ProtocolDAG from a Transformation; add reason field and populate it

component-compute-api

component-compute-client

component-compute-service

component-statestore

component-user-api

component-user-client

Status: Open.

#195 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Oct 25, 2023

Add AlchemiscaleClient method for producing archival-quality extracts of AlchemicalNetworks and their existing results

component-objectstore

component-statestore

component-user-api

component-user-client

enhancementNew feature or requestNew feature or request

user-story

Status: Open.

#246 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Feb 23, 2024

Add TaskProvenance node with relationship to both a ProtocolDAGResultRef and its associated Task upon error or complete

Status: Open.

#106 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Mar 28, 2023

Add ProtocolUnit log preservation to compute services and object store, with reference in state store; expose via AlchemiscaleClient

component-compute-api

component-compute-client

component-compute-service

component-objectstore

component-statestore

component-user-api

component-user-client

Status: Open.

#349 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Jan 8, 2025

Add AlchemiscaleClient method for getting percentage of compute consumed currently in given Scope relative to all other Scopes at same level

Status: Open.

#389 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Mar 18, 2025

Add mechanism for introspecting progress of a ProtocolDAG as it is running

component-compute-api

component-compute-client

component-compute-service

component-statestore

Status: Open.

#415 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Jun 24, 2025

Weight selection of AlchemicalNetworks for Task claiming by Transformation count?

questionFurther information is requestedFurther information is requested

Status: Open.

#393 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Apr 1, 2025

[WIP] Adds ComputeServiceID form enforcement

Status: Open (in progress).

OpenFreeEnergy/alchemiscalenumber 467

#467 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Dec 10, 2025

[WIP] API enforced number of TaskHub actioned tasks and number of waiting tasks per Transformation

Status: Open (in progress).

OpenFreeEnergy/alchemiscalenumber 457

#457 In OpenFreeEnergy/alchemiscale;

· ianmkenney opened on Nov 17, 2025

Retain stdout, stderr logs from ProtocolDAGResults; expose access via AlchemiscaleClient

component-compute-api

component-compute-client

component-compute-service

component-objectstore

component-statestore

component-user-api

component-user-client

Status: Open.

#295 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Aug 27, 2024