choderalab

choderalab/drugforge

Toolkit for open antiviral drug discovery by the Choderalab (formerly ASAP)

8 good first / help-wanted issues · Python · last activity Aug 29, 2026

14 stars 1 forks 14 watchers Python MIT License

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8 Open Issues Need Help Last updated: Aug 29, 2026

Open Issues Need Help

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Update to support latest `cinnabar` 0.5.0 about 2 months ago

enhancement good first issue

choderalab/drugforge

14

Toolkit for open antiviral drug discovery by the Choderalab (formerly ASAP)

Python

Less frequent run of long CI tests 6 months ago

enhancement good first issue

choderalab/drugforge

14

Toolkit for open antiviral drug discovery by the Choderalab (formerly ASAP)

Python

Review `alchemy` uncertainty computation for FE prediction 6 months ago

bug good first issue

choderalab/drugforge

14

Toolkit for open antiviral drug discovery by the Choderalab (formerly ASAP)

Python

Migrating to pixi (or similar)? 7 months ago

enhancement good first issue

choderalab/drugforge

14

Toolkit for open antiviral drug discovery by the Choderalab (formerly ASAP)

Python

Resume the docker container artifact generation 7 months ago

enhancement good first issue

choderalab/drugforge

14

Toolkit for open antiviral drug discovery by the Choderalab (formerly ASAP)

Python

Remove all references to `pkg_resources` 8 months ago

enhancement good first issue

choderalab/drugforge

14

Toolkit for open antiviral drug discovery by the Choderalab (formerly ASAP)

Python

Renaming serialized ml models in testing data over 1 year ago

AI Summary: Rename serialized machine learning models in the testing data of the `drugforge` (formerly `asapdiscovery`) project to reflect the rebranding, potentially making them agnostic to the package name. This involves updating the `asap_models.yaml` file and potentially other related files.

Complexity: 3/5

enhancement good first issue

choderalab/drugforge

14

Toolkit for open antiviral drug discovery by the Choderalab (formerly ASAP)

Python

ReadTheDocs for drugforge after renaming over 1 year ago

AI Summary: Configure ReadTheDocs to build and host documentation for the renamed `drugforge` package, requiring updates to the build configuration and potentially the documentation source files to reflect the new name.

Complexity: 3/5

documentation good first issue

choderalab/drugforge

14

Toolkit for open antiviral drug discovery by the Choderalab (formerly ASAP)

Python