source: tests/regression/Atoms

Candidate_v1.6.1
Name Size Rev Age Author Last Change
../
Add 3fb9ab   8 years FrederikHeber FIX: Preventing MPQC from using old temp files for restart. - …
ChangeElement 0d97b4   12 years FrederikHeber FIX: Disclaimer appeared twice in each testsuite. Second time removed.
Mirror bbf6dc   10 years FrederikHeber Added AtomMirrorAction. - also added regression tests.
RandomPerturbation 43552e   6 years frederik.heber DISTFIX: Atom regression test RandomPerturbation did mark the input …
Remove 3fb9ab   8 years FrederikHeber FIX: Preventing MPQC from using old temp files for restart. - …
RemoveCuboid 0d97b4   12 years FrederikHeber FIX: Disclaimer appeared twice in each testsuite. Second time removed.
RemoveSphere 0d97b4   12 years FrederikHeber FIX: Disclaimer appeared twice in each testsuite. Second time removed.
Saturate c4abf2   8 years FrederikHeber TEST: Added regression tests on saturating partially bonded atoms.
SaveSelectedAtoms 0d97b4   12 years FrederikHeber FIX: Disclaimer appeared twice in each testsuite. Second time removed.
Translation 066442   10 years FrederikHeber Added TranslateMolecule action. - added translate-molecule to …
TranslationToOrigin c7fe90   10 years FrederikHeber Added TranslateToOriginAction. - also added regression test.
testsuite-atoms.at 1.9 KB 310445   8 years frederik.heber Added RandomPerturbationAction. - this should be when doing …
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