Cheminformatics - Quality Assurance

Summary

Autoremovals: 2

Migration issues: 1

CI failures: 3

Install issues: 1

No issues: 2/12

DebiChem Cheminformatics

This metapackage will install cheminformatics packages useful for chemists.

rdkit

😟 Autoremoval

😟 CI

Package marked for automatic removal:

Will be removed on: 2025-10-04
Bugs leading to autoremoval: #1110701
Will result in removal of coot parmed pytorch-geometric votca with total popcon score of 0

Continuous integration (CI) tests are failing:

Testsuite: autopkgtest

osra

😟 Autoremoval

😟 Install/upgrade

😑 Tests missing

Package marked for automatic removal:

Will be removed on: 2025-10-09
Dependencies leading to autoremoval: xli
Bugs in dependencies leading to autoremoval: #1098150

Piuparts failed:

Version: 2.1.3-4
Sections: oldstable222sid

Continuous integration (CI) tests are missing.

smiles-scripts

😟 CI

😟 Migration

Continuous integration (CI) tests are failing:

Testsuite: autopkgtest

Migration from unstable to testing is blocked:

Not in testing for 30 days.
Verdict: Rejected/violates migration policy/introduces a regression
Reason: autopkgtest

openchemlib

😟 CI

Continuous integration (CI) tests are failing:

Testsuite: autopkgtest

cdk

😑 Tests missing

Continuous integration (CI) tests are missing.

chemicaltagger

😑 Tests missing

Continuous integration (CI) tests are missing.

inchi

😑 Tests missing

Continuous integration (CI) tests are missing.

indigo

😑 Tests missing

Continuous integration (CI) tests are missing.

jni-inchi

😑 Tests missing

Continuous integration (CI) tests are missing.

oscar4

😑 Tests missing

Continuous integration (CI) tests are missing.