Changeset be729b for tests/Python/ForceAnnealing/testsuite-python-forceannealing-ising.at

Timestamp:

Apr 10, 2018, 6:43:30 AM (7 years ago)

Author:

Frederik Heber <frederik.heber@…>

Branches:

AutomationFragmentation_failures, Candidate_v1.6.1, ChemicalSpaceEvaluator, Exclude_Hydrogens_annealWithBondGraph, ForceAnnealing_with_BondGraph, ForceAnnealing_with_BondGraph_contraction-expansion, Gui_displays_atomic_force_velocity, PythonUI_with_named_parameters, StoppableMakroAction, TremoloParser_IncreasedPrecision

Children:

038ccd

Parents:

6458e7

git-author:

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

git-committer:

Frederik Heber <frederik.heber@…> (04/10/18 06:43:30)

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/Python/ForceAnnealing/testsuite-python-forceannealing-ising.at (modified) (2 diffs)

tests/Python/ForceAnnealing/testsuite-python-forceannealing-ising.at

@@ -20 +20 @@
 AT_SETUP([Python externalization - Force Annealing without bondgraph on 2-body Ising model])
 AT_KEYWORDS([python force-annealing ising])
+AT_XFAIL_IF([/bin/true])
 
 # we use forces from a simple Ising model with 2 "carbon" atoms in a row along the x axis
@@ -32 +33 @@
 AT_SETUP([Python externalization - Force Annealing without bondgraph on 5-body Ising model])
 AT_KEYWORDS([python force-annealing ising])
+AT_XFAIL_IF([/bin/true])
 
 # we use forces from a simple Ising model with 5 "carbon" atoms in a row along the x axis