source: tests/Fragmentations/Fragmenting@ 6491d3

Adding_MD_integration_tests Adding_StructOpt_integration_tests AutomationFragmentation_failures Candidate_v1.6.1 Candidate_v1.7.0 ChemicalSpaceEvaluator Enhanced_StructuralOptimization Enhanced_StructuralOptimization_continued Exclude_Hydrogens_annealWithBondGraph ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_contraction-expansion Gui_displays_atomic_force_velocity JobMarket_RobustOnKillsSegFaults JobMarket_StableWorkerPool PythonUI_with_named_parameters StoppableMakroAction TremoloParser_IncreasedPrecision stable
Name Size Rev Age Author Last Change
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1_2-dimethoxyethane c9db50   11 years FrederikHeber FIX: Removed doubly occuring disclaimer in testsuite files in …
1_2-dimethylbenzene c9db50   11 years FrederikHeber FIX: Removed doubly occuring disclaimer in testsuite files in …
2-methylcyclohexanone c9db50   11 years FrederikHeber FIX: Removed doubly occuring disclaimer in testsuite files in …
anthracene 2cb77c   11 years FrederikHeber FIX: Fragmentations tests used -I and not --correct-bonddegree in case …
benzene c9db50   11 years FrederikHeber FIX: Removed doubly occuring disclaimer in testsuite files in …
cholesterol c9db50   11 years FrederikHeber FIX: Removed doubly occuring disclaimer in testsuite files in …
coronene 2cb77c   11 years FrederikHeber FIX: Fragmentations tests used -I and not --correct-bonddegree in case …
cycloheptane c9db50   11 years FrederikHeber FIX: Removed doubly occuring disclaimer in testsuite files in …
dimethyl_bromomalonate c9db50   11 years FrederikHeber FIX: Removed doubly occuring disclaimer in testsuite files in …
glucose c9db50   11 years FrederikHeber FIX: Removed doubly occuring disclaimer in testsuite files in …
heptan c9db50   11 years FrederikHeber FIX: Removed doubly occuring disclaimer in testsuite files in …
isoleucine c9db50   11 years FrederikHeber FIX: Removed doubly occuring disclaimer in testsuite files in …
N_N-dimethylacetamide c9db50   11 years FrederikHeber FIX: Removed doubly occuring disclaimer in testsuite files in …
naphthalene 2cb77c   11 years FrederikHeber FIX: Fragmentations tests used -I and not --correct-bonddegree in case …
neohexane c9db50   11 years FrederikHeber FIX: Removed doubly occuring disclaimer in testsuite files in …
phenanthrene 2cb77c   11 years FrederikHeber FIX: Fragmentations tests used -I and not --correct-bonddegree in case …
proline c9db50   11 years FrederikHeber FIX: Removed doubly occuring disclaimer in testsuite files in …
putrescine c9db50   11 years FrederikHeber FIX: Removed doubly occuring disclaimer in testsuite files in …
tartaric_acid c9db50   11 years FrederikHeber FIX: Removed doubly occuring disclaimer in testsuite files in …
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