Candidate_v1.6.1
        Candidate_v1.7.0
        ChemicalSpaceEvaluator
        stable
      
      
      
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| [dd6c07] | 1 | #
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 | 2 | #    MoleCuilder - creates and alters molecular systems
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 | 3 | #    Copyright (C) 2008-2012 University of Bonn
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| [d50b91] | 4 | #    Copyright (C) 2013-2016 Frederik Heber
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| [dd6c07] | 5 | #
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 | 6 | #    This program is free software: you can redistribute it and/or modify
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 | 7 | #    it under the terms of the GNU General Public License as published by
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 | 8 | #    the Free Software Foundation, either version 3 of the License, or
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 | 9 | #    (at your option) any later version.
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 | 10 | #
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 | 11 | #    This program is distributed in the hope that it will be useful,
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 | 12 | #    but WITHOUT ANY WARRANTY; without even the implied warranty of
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 | 13 | #    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
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 | 14 | #    GNU General Public License for more details.
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 | 15 | #
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 | 16 | #    You should have received a copy of the GNU General Public License
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 | 17 | #    along with this program.  If not, see <http://www.gnu.org/licenses/>.
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 | 18 | #
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 | 19 | AT_BANNER([MoleCuilder - fragmentation tests])
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 | 20 | 
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 | 21 | # check fragmentation
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 | 22 | m4_include([Fragmentation/FragmentMolecule/testsuite-fragmentation-fragment-molecule.at])
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 | 23 | 
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 | 24 | # check analysis
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 | 25 | m4_include([Fragmentation/AnalyseFragmentationResults/testsuite-fragmentation-analyse-fragment-results.at])
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 | 26 | 
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 | 27 | # check whether parsing of BondFragment files and re-rwriting config files is working (exit code is 2 as we don't need to continue wrt to ...OrderAtSite)
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 | 28 | m4_include([Fragmentation/FragmentMolecule-MaxOrder/testsuite-fragmentation-fragment-molecule-maxorder.at])
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 | 29 | 
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 | 30 | # check storing saturated fragment
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 | 31 | m4_include([Fragmentation/StoreSaturatedFragment/testsuite-fragmentation-store-saturated-fragment.at])
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 | 32 | 
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 | 33 | # check automation
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| [d50b91] | 34 | m4_include([Fragmentation/FragmentationAutomation/testsuite-fragmentation-fragmentation-automation.at])
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 | 35 | 
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 | 36 | # parse/save state of FragmentationResultsContainer
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 | 37 | m4_include([Fragmentation/ParseSaveFragmentResults/testsuite-fragmentation-parse-save-fragment-results.at])
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