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Fixed bug that made --print output inconsitent #112

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Merged
charnley merged 6 commits into from
Nov 23, 2024
Merged

Fixed bug that made --print output inconsitent #112

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612552e
Added tests for --no-hydrogen --print is consistent
charnley Nov 19, 2024
826ca3e
fix the printed structure with selected atoms (#111)
takafumi-shiraogawa Nov 23, 2024
7f5101d
Updated test coverage to cover bad --print order, Restructured main t…
charnley Nov 23, 2024
098a480
Deleted duplicate test files
charnley Nov 23, 2024
04dc65c
Removed unused protocol
charnley Nov 23, 2024
9424f25
Removed out-commented code and added clarification comment
charnley Nov 23, 2024
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Deleted duplicate test files
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@charnley
charnley committed Nov 23, 2024
commit 098a480c753820ea69cb1bc37d923d3f671b480a
4 changes: 0 additions & 4 deletions tests/resources/pr111/ethane_no_hydrogen.xyz
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4 changes: 0 additions & 4 deletions tests/resources/pr111/ethane_translate_no_hydrogen.xyz
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