Greg Landrum
d85117f852
Fix #3312 ( #3313 )
...
* additional testing: ensure we can delete SubstanceGroups
* fixes #3312
* stupid test mistake
* Fixes #3315
2020-08-12 09:48:43 +02:00
Greg Landrum
2937e29b66
add GetStringVectProp() to SubstanceGroup class so that DATAFIELDS can be used ( #3251 )
2020-06-27 06:41:12 +02:00
Greg Landrum
27b5b576bd
basic handling of XBCORR and XBHEAD ( #3242 )
2020-06-27 06:40:47 +02:00
Greg Landrum
d41752d558
run clang-tidy with readability-braces-around-statements ( #2899 )
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* run clang-tidy with readability-braces-around-statements
clang-format the results
clean up all the parts that clang-tidy-8 broke
* fix problem on windows
2020-01-25 14:19:32 +01:00
Greg Landrum
e49317bfcb
merge
2019-10-25 04:48:08 +02:00
Eisuke Kawashima
9d10c7c4b7
Change line ending from CR+LF to LF [ci skip]
2019-10-21 11:39:25 +09:00
Greg Landrum
e5620e0c57
[WIP] Make StructureGroups editable from Python ( #2692 )
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* first steps towards StructureGroups being editable in Python
* typo fix
* Add initial features to allow editing SGroups from Python.
* update test
* typo
2019-10-15 22:32:26 -04:00
Greg Landrum
5a79190261
rename SGroup -> SubstanceGroup ( #2375 )
...
We leave the names of the bit connected with Mol files as SGroups, since that is
appropriate there, but the more generic pieces are renamed
2019-03-30 14:53:24 -04:00
