Changeset e96f35 for tests/regression/Molecules/ForceAnnealing/testsuite-molecules-force-annealing.at

Timestamp:

Nov 12, 2017, 8:40:54 AM (7 years ago)

Author:

Frederik Heber <frederik.heber@…>

Branches:

ForceAnnealing_with_BondGraph_continued_betteresults

Children:

9e7a02

Parents:

d34446

git-author:

Frederik Heber <frederik.heber@…> (06/27/17 21:13:13)

git-committer:

Frederik Heber <frederik.heber@…> (11/12/17 08:40:54)

Message:

ForceAnnealing::anneal() now only once reduces deltat.

• TESTFIX: Marked regression test ForceAnnealing (and redo) as XFAIL as we have removed storing the position update in the atomic velocities.
• TESTFIX: Marked Python tests on ForceAnnealing without bondgraph as XFAIL for the same reason.

File:

• tests/regression/Molecules/ForceAnnealing/testsuite-molecules-force-annealing.at (modified) (2 diffs)

tests/regression/Molecules/ForceAnnealing/testsuite-molecules-force-annealing.at

@@ -20 +20 @@
 AT_SETUP([Molecules - Force Annealing])
 AT_KEYWORDS([molecules force-annealing])
+AT_XFAIL_IF([/bin/true])
 
 file=test.conf
@@ -61 +62 @@
 AT_SETUP([Molecules - Force Annealing with Redo])
 AT_KEYWORDS([molecules force-annealing redo])
+AT_XFAIL_IF([/bin/true])
 
 file=test.conf