source: ThirdParty/mpqc_open/src/lib/validate/testsuite.at

stable v1.7.0
Last change on this file was 9259c3, checked in by Frederik Heber <frederik.heber@…>, 6 weeks ago

MPQC_OPEN: Fixes unit tests.

  • several unit tests programs actually need arguments. Those have been copnverted to autotest test cases.
  • half of these new test cases are expected to fail because modules cannot be properly loaded.
  • Property mode set to 100644
File size: 1.4 KB
Line 
1#
2# MoleCuilder - creates and alters molecular systems
3# Copyright (C) 2025 Frederik Heber
4#
5# This program is free software: you can redistribute it and/or modify
6# it under the terms of the GNU General Public License as published by
7# the Free Software Foundation, either version 3 of the License, or
8# (at your option) any later version.
9#
10# This program is distributed in the hope that it will be useful,
11# but WITHOUT ANY WARRANTY; without even the implied warranty of
12# MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
13# GNU General Public License for more details.
14#
15# You should have received a copy of the GNU General Public License
16# along with this program. If not, see <http://www.gnu.org/licenses/>.
17#
18# Process with autom4te to create an -*- Autotest -*- test suite.
19#
20# see regression/... subdirs wherein for each of the cases and each check (enumerated) is a pre and post dir.
21# In pre initial files are placed, in post results can be found to be checked by diff in this testsuite.
22
23AT_INIT([MPQC])
24
25m4_include(util/options/testsuite-sample.at)
26m4_include(chemistry/molecule/testsuite-symmetrize.at)
27m4_include(chemistry/qc/mbpt/testsuite-mbpttest.at)
28m4_include(chemistry/qc/psi/testsuite-psitest.at)
29m4_include(chemistry/solvent/testsuite-bemtest.at)
30m4_include(math/isosurf/testsuite-isotest.at)
31m4_include(math/optimize/testsuite-kvopt.at)
32m4_include(math/optimize/testsuite-scextest-optimize.at)
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