Molecular dynamics - Quality Assurance

Summary

Autoremovals: 2

Migration issues: 5

CI failures: 6

Install issues: 6

No issues: 0/9

DebiChem Molecular Dynamics

This metapackage will install Molecular Dynamics packages which might be useful for chemists.

lammps

😟 Autoremoval

😟 CI

😟 Install/upgrade

Package marked for automatic removal:

  • Will be removed on: 2025-03-12
  • Dependencies leading to autoremoval: spglib
  • Bugs in dependencies leading to autoremoval: #1094359

Continuous integration (CI) tests are failing:

Piuparts failed:

adun.app

😟 Autoremoval

😑 Tests missing

Package marked for automatic removal:

Continuous integration (CI) tests are missing.

cp2k

😟 CI

😟 Migration

😟 Install/upgrade

Continuous integration (CI) tests are failing:

Migration from unstable to testing is blocked:

  • Not in testing for 358 days.
  • Verdict: Rejected/violates migration policy/introduces a regression
  • Reason: autopkgtest, missingbuild

Piuparts failed:

prody

😟 CI

😟 Migration

😟 Install/upgrade

Continuous integration (CI) tests are failing:

Migration from unstable to testing is blocked:

  • Not in testing for 412 days.
  • Verdict: Rejected/violates migration policy/introduces a regression
  • Reason: autopkgtest, depends, missingbuild

Piuparts failed:

parmed

😟 CI

😟 Migration

Continuous integration (CI) tests are failing:

Migration from unstable to testing is blocked:

  • Not in testing for 36 days.
  • Verdict: Cannot migrate due to another item, which is blocked (please check which dependencies are stuck)
  • Reason: build-depends
  • Invalidated by another package
  • Blocked by: rdkit

votca

😟 Migration

😟 Install/upgrade

😑 Tests missing

Migration from unstable to testing is blocked:

  • Not in testing for 30 days.
  • Verdict: Cannot migrate due to another item, which is blocked (please check which dependencies are stuck)
  • Reason: build-depends
  • Invalidated by another package
  • Blocked by: rdkit

Piuparts failed:

Continuous integration (CI) tests are missing.

gromacs

😟 CI

😟 Install/upgrade

Continuous integration (CI) tests are failing:

Piuparts failed:

nwchem

😟 CI

😟 Install/upgrade

Continuous integration (CI) tests are failing:

Piuparts failed:

cpptraj

😟 Migration

Migration from unstable to testing is blocked:

  • Not in testing for 17 days.
  • Verdict: Rejected/violates migration policy/introduces a regression