Search results

Add mechanism for introspecting progress of a <code>ProtocolDAG</code> 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

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Release 0.8.0 - "living networks" enablement

Support for autoscaling compute services on a variety of platforms

enhancementNew feature or requestNew feature or request

feature-autoscaling

Status: Open.

Feature

#410 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on May 13, 2025

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Release 0.7.0 - automated strategy execution

Add CLI endpoint for replacing identity key

bugSomething isn't workingSomething isn't working

component-cli

component-statestore

Status: Open.

#406 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Apr 29, 2025

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Release 0.9.0 - improved compute efficiency for parallelizable `ProtocolDAG`s

Deprecated <code>utcnow</code> function in Python&gt;=3.12

good first issueGood for newcomersGood for newcomers

Status: Open.

#404 In OpenFreeEnergy/alchemiscale;

· ianmkenney opened on Apr 21, 2025

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Release 0.7.0 - automated strategy execution

Deprecated <code>dict</code> method in <code>pydantic</code> v2

good first issueGood for newcomersGood for newcomers

Status: Open.

#403 In OpenFreeEnergy/alchemiscale;

· ianmkenney opened on Apr 21, 2025

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Release 0.7.0 - automated strategy execution

Weight selection of <code>AlchemicalNetwork</code>s for <code>Task</code> claiming by <code>Transformation</code> count?

questionFurther information is requestedFurther information is requested

Status: Open.

#393 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Apr 1, 2025

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Release 0.7.0 - automated strategy execution

Add <code>AlchemiscaleClient</code> method for getting percentage of compute consumed currently in given <code>Scope</code> relative to all other <code>Scope</code>s at same level

Status: Open.

#389 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Mar 18, 2025

· 

Release 0.8.0 - "living networks" enablement

Add compute API methods to enable autoscaling of compute services

component-compute-api

component-compute-client

feature-autoscaling

Status: Open.

Feature

#388 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Mar 18, 2025

· 

Release 0.7.0 - automated strategy execution

Silence pickle warning for ExplicitMoleculeComponent?

Status: Open.

#376 In OpenFreeEnergy/alchemiscale;

· IAlibay opened on Mar 6, 2025

Implement unoptimized MVP that performs a <code>Strategy</code> given <code>AlchemicalNetwork</code> data and yields counts of <code>Task</code>s to action for the network's <code>Transformation</code>s

component-strategist

Status: Open.

Feature

#374 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Mar 4, 2025

· 

Release 0.7.0 - automated strategy execution

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

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

· 

Release 0.8.0 - "living networks" enablement

Change all <code>AlchemiscaleClient</code> methods to use <code>retrieve_*</code> instead of <code>get_*</code> if they return <code>GufeTokenizable</code>s

component-user-api

component-user-client

Status: Open.

#348 In OpenFreeEnergy/alchemiscale;

· dotsdl opened on Jan 7, 2025

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Release 1.0.0 - API stability over 1.x release series