# # ChangeLog for tests # # Generated by Trac 1.4.4 # Dec 29, 2024, 7:35:02 AM Tue, 06 Oct 2009 17:56:15 GMT Frederik Heber [ebcade] * src/builder.cpp (modified) * tests/Makefile.am (modified) * tests/regression/Fragmentation/1/pre/test.conf (added) * tests/regression/Fragmentation/2/post/BondFragment0.conf (added) * tests/regression/Fragmentation/2/post/BondFragment0.conf.xyz (added) * tests/regression/Fragmentation/2/post/BondFragment1.conf (added) * tests/regression/Fragmentation/2/post/BondFragment1.conf.xyz (added) * tests/regression/Fragmentation/2/post/BondFragment2.conf (added) * tests/regression/Fragmentation/2/post/BondFragment2.conf.xyz (added) * tests/regression/Fragmentation/2/post/BondFragment3.conf (added) * tests/regression/Fragmentation/2/post/BondFragment3.conf.xyz (added) * tests/regression/Fragmentation/2/post/BondFragment4.conf (added) * tests/regression/Fragmentation/2/post/BondFragment4.conf.xyz (added) * tests/regression/Fragmentation/2/post/BondFragmentAdjacency.dat (added) * tests/regression/Fragmentation/2/post/BondFragmentForces-Factors.dat (added) * tests/regression/Fragmentation/2/post/BondFragmentKeySets.dat (added) * tests/regression/Fragmentation/2/post/BondFragmentOrderAtSite.dat (added) * tests/regression/Fragmentation/2/post/BondFragmentTE-Factors.dat (added) * tests/regression/Fragmentation/2/post/test.conf (added) * tests/regression/Fragmentation/2/pre/test.conf (added) * tests/regression/Fragmentation/3/pre/BondFragment0.conf (added) * tests/regression/Fragmentation/3/pre/BondFragment0.conf.xyz (added) * tests/regression/Fragmentation/3/pre/BondFragment1.conf (added) * tests/regression/Fragmentation/3/pre/BondFragment1.conf.xyz (added) * tests/regression/Fragmentation/3/pre/BondFragment2.conf (added) * tests/regression/Fragmentation/3/pre/BondFragment2.conf.xyz (added) * tests/regression/Fragmentation/3/pre/BondFragment3.conf (added) * tests/regression/Fragmentation/3/pre/BondFragment3.conf.xyz (added) * tests/regression/Fragmentation/3/pre/BondFragment4.conf (added) * tests/regression/Fragmentation/3/pre/BondFragment4.conf.xyz (added) * tests/regression/Fragmentation/3/pre/BondFragmentAdjacency.dat (added) * tests/regression/Fragmentation/3/pre/BondFragmentForces-Factors.dat (added) * tests/regression/Fragmentation/3/pre/BondFragmentKeySets.dat (added) * tests/regression/Fragmentation/3/pre/BondFragmentOrderAtSite.dat (added) * tests/regression/Fragmentation/3/pre/BondFragmentTE-Factors.dat (added) * tests/regression/Fragmentation/3/pre/test.conf (added) * tests/regression/Graph/1/post/test.conf (added) * tests/regression/Graph/1/pre/test.conf (added) * tests/regression/Simple_configuration/1/post/test.xyz (added) * tests/regression/Simple_configuration/2/post/test.conf (added) * tests/regression/Simple_configuration/2/post/test.conf.xyz (added) * tests/regression/Simple_configuration/2/pre/test.xyz (added) * tests/regression/Simple_configuration/3/post/test.conf (added) * tests/regression/Simple_configuration/3/post/test.conf.xyz (added) * tests/regression/Simple_configuration/4/post/test.conf (added) * tests/regression/Simple_configuration/4/post/test.conf.xyz (added) * tests/regression/Simple_configuration/4/pre/test.conf (added) * tests/regression/Simple_configuration/5/post/test.conf (added) * tests/regression/Simple_configuration/5/post/test.conf.xyz (added) * tests/regression/Simple_configuration/5/pre/test.conf (added) * tests/regression/Simple_configuration/6/pre/empty.conf (added) * tests/regression/Simple_configuration/7/pre/test.conf (added) * tests/regression/Tesselation/1/post/NonConvexEnvelope.dat (added) * tests/regression/Tesselation/1/post/NonConvexEnvelope.r3d (added) * tests/regression/Tesselation/1/post/test.conf (added) * tests/regression/Tesselation/1/pre/test.conf (added) * tests/regression/Tesselation/2/post/ConvexEnvelope.dat (added) * tests/regression/Tesselation/2/post/ConvexEnvelope.r3d (added) * tests/regression/Tesselation/2/post/NonConvexEnvelope.dat (added) * tests/regression/Tesselation/2/post/NonConvexEnvelope.r3d (added) * tests/regression/Tesselation/2/post/test.conf (added) * tests/regression/Tesselation/2/pre/test.conf (added) * tests/regression/Tesselation/3/post/NonConvexEnvelope.dat (added) * tests/regression/Tesselation/3/post/NonConvexEnvelope.r3d (added) * tests/regression/Tesselation/3/post/tecplot.phy (added) * tests/regression/Tesselation/3/post/test.conf (added) * tests/regression/Tesselation/3/pre/test.conf (added) * tests/regression/Tesselation/4/post/NonConvexEnvelope.dat (added) * tests/regression/Tesselation/4/post/NonConvexEnvelope.r3d (added) * tests/regression/Tesselation/4/post/test.conf (added) * tests/regression/Tesselation/4/pre/test.conf (added) * tests/testsuite.at (modified) Extended the testsuite to encompass the vital areas of molecuilder. ... Mon, 05 Oct 2009 17:21:58 GMT Frederik Heber [c26f44] * src/Makefile.am (modified) * src/atom.cpp (modified) * src/builder.cpp (modified) * src/memoryallocator.hpp (modified) * src/memoryusageobserver.cpp (modified) * src/memoryusageobserver.hpp (modified) * src/molecules.cpp (modified) * src/tesselation.cpp (modified) * src/tesselationunittest.cpp (modified) * tests/testsuite.at (modified) Fixed testsuite, removed some minor bugs. - ... Mon, 09 Feb 2009 17:24:10 GMT Frederik Heber [6ac7ee] * ChangeLog (modified) * Makefile.am (modified) * configure.ac (modified) * doc/Doxyfile (modified) * doc/Makefile.am (modified) * m4/ac_doxygen.m4 (modified) * m4/acx_compilerflags.m4 (modified) * src/.#border.cpp (deleted) * src/.#molecules.hpp (deleted) * src/Hbondangle.db (modified) * src/Hbonddistance.db (modified) * src/Makefile.am (modified) * src/analyzer.cpp (modified) * src/atom.cpp (modified) * src/bond.cpp (modified) * src/boundary.cpp (modified) * src/boundary.hpp (modified) * src/builder.cpp (modified) * src/config.cpp (modified) * src/datacreator.cpp (modified) * src/datacreator.hpp (modified) * src/defs.hpp (modified) * src/element.cpp (modified) * src/elements.db (modified) * src/ellipsoid.cpp (added) * src/ellipsoid.hpp (added) * src/graph.cpp (modified) * src/helpers.cpp (modified) * src/helpers.hpp (modified) * src/joiner.cpp (modified) * src/linkedcell.cpp (modified) * src/linkedcell.hpp (modified) * src/moleculelist.cpp (modified) * src/molecules.cpp (modified) * src/molecules.hpp (modified) * src/orbitals.db (modified) * src/parser.cpp (modified) * src/parser.hpp (modified) * src/periodentafel.cpp (modified) * src/periodentafel.hpp (modified) * src/stackclass.hpp (modified) * src/valence.db (modified) * src/vector.cpp (modified) * src/vector.hpp (modified) * src/verbose.cpp (modified) * tests/Makefile.am (modified) * tests/atlocal.in (modified) * tests/molecuilder.in (modified) * tests/testsuite.at (modified) Merge branch 'ConcaveHull' of ../espack2 into ConcaveHull ... Thu, 16 Oct 2008 09:27:59 GMT Frederik Heber [f00693] * tests/testsuite.at (modified) New tests that check that if subsequent arguments to certain cmd ... Mon, 18 Aug 2008 10:55:30 GMT Frederik Heber [ab3a0e] * tests/testsuite.at (modified) Fixed second test (main_pcp_linux was not written anymore, hence ... Mon, 26 May 2008 13:28:28 GMT Frederik Heber [37b5bb] * src/periodentafel.cpp (modified) * tests/testsuite.at (modified) renamed ElementsFileName to PathToDatabases, -e now gives path to ... Mon, 26 May 2008 13:21:19 GMT Frederik Heber [c9c643] * tests/testsuite.at (modified) fragmentation no more has various methods (dropped ... A) Tue, 29 Apr 2008 07:55:11 GMT Frederik Heber [1fa5b7] * tests/testsuite.at (modified) config file is again first argument and implemented test of ... Tue, 29 Apr 2008 07:06:18 GMT Frederik Heber [3c1dfb] * tests/testsuite.at (modified) Full test for fragmentation procedure with readin of the adjacency ... Sun, 27 Apr 2008 13:05:46 GMT Frederik Heber [f3cba6] * tests/Makefile.am (added) * tests/atlocal.in (added) * tests/molecuilder.in (added) * tests/testsuite.at (added) forgot to commit the actual autotest files listed during last commit, ...