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OpenEye Constrained Conformer Enumeration fails for partial ring matches.

Status: Open.

#148 In choderalab/drugforge;

· apayne97 opened on Apr 7, 2026

Fix Ligand from OEGraphMol bug

Status: Open.

#146 In choderalab/drugforge;

· apayne97 opened on Apr 1, 2026

·  

release 0.7.3

Review alchemy uncertainty computation for FE prediction

bugSomething isn't workingSomething isn't working

good first issueGood for newcomersGood for newcomers

Status: Open.

Bug

#144 In choderalab/drugforge;

· ijpulidos opened on Mar 25, 2026

·  

release 0.8.1

Migrating to pixi (or similar)?

enhancementNew feature or requestNew feature or request

good first issueGood for newcomersGood for newcomers

Status: Open.

Feature

#143 In choderalab/drugforge;

· ijpulidos opened on Mar 25, 2026

·  

release 0.8.1

PreppedComplex and PreppedTarget do not inherit from Complex and Target, which is confusing

Status: Open.

#142 In choderalab/drugforge;

· apayne97 opened on Mar 24, 2026

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release 0.8.1

Modularize fixtures

Status: Open.

#139 In choderalab/drugforge;

· ijpulidos opened on Mar 3, 2026

MacOS CI failing for alchemy

Status: Open.

#138 In choderalab/drugforge;

· ijpulidos opened on Mar 2, 2026

really slow CI due to install packages

Status: Open.

#137 In choderalab/drugforge;

· chrisiacovella opened on Feb 27, 2026

Continuously test the tutorials

Status: Open.

#133 In choderalab/drugforge;

· ijpulidos opened on Jan 29, 2026

·  

release 0.8.1

dataviz CI aborted -- core dumped

Status: Open.

#130 In choderalab/drugforge;

· ijpulidos opened on Jan 14, 2026

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release 0.8

Using ubuntu-slim containers for github actions CI

Status: Open.

#129 In choderalab/drugforge;

· ijpulidos opened on Jan 14, 2026

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release 0.8

Prep issues with terminal caps and OpenMM simulation

Status: Open.

#128 In choderalab/drugforge;

· apayne97 opened on Jan 13, 2026