Molecular ab initio calculations - Quality Assurance

Summary

Autoremovals: 0

Migration issues: 3

CI failures: 2

Install issues: 5

No issues: 2/9

DebiChem Molecular Ab Initio Calculations

This metapackage will install packages doing molecular ab initio calculations which might be useful for chemists.

mpqc

😟 Migration

😟 Install/upgrade

😑 Tests missing

Migration from unstable to testing is blocked:

Not in testing for 273 days.
Verdict: Rejected/violates migration policy/introduces a regression
Reason: autopkgtest, block, depends

Piuparts failed:

Version: 2.3.1-22
Sections: sid-strict stable2sid sid-nodoc sid-broken-symlinks stable22sid oldstable222sid

Continuous integration (CI) tests are missing.

chemps2

😟 Migration

😟 Install/upgrade

Migration from unstable to testing is blocked:

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

Piuparts failed:

Version: 1.8.3-2
Sections: jessie2bpo2stretch

psi4

😟 Migration

😟 Install/upgrade

Migration from unstable to testing is blocked:

Not in testing for 542 days.
Verdict: Rejected/violates migration policy/introduces a regression
Reason: autopkgtest, block
Migrates after: chemps2

Piuparts failed:

Version: 4.0~beta5+dfsg-2
Sections: jessie

cp2k

😟 CI

😟 Install/upgrade

Continuous integration (CI) tests are failing:

Testsuite: autopkgtest

Piuparts failed:

Version: 4.1-1
Sections: jessie-lts2stretch jessie2bpo2stretch jessie2Xstretch

openmolcas

😟 CI

Continuous integration (CI) tests are failing:

Testsuite: autopkgtest, autopkgtest-pkg-python

nwchem

😟 Install/upgrade

Piuparts failed:

Version: None
Sections: jessie-lts2stretch jessie2Xstretch jessie2stretch

ergo

😑 Tests missing

Continuous integration (CI) tests are missing.