#1589 Apply hydrogens folding/unfolding with respect to selected atoms
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GitHub Actions / windows-x86_64-python_test_report
failed
Jan 18, 2024 in 0s
258 tests run, 257 passed, 0 skipped, 1 failed.
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Check failure on line 1 in deco
github-actions / windows-x86_64-python_test_report
deco.deco_iter
[FAILED]
Raw output
Diff:
+ M V30 BEGIN COLLECTION
+ M V30 MDLV30/HILITE BONDS=(1 1)
+ M V30 END COLLECTION
- 2 1 0 0 0 0 0 0 0 0999 V2000
+ 0 0 0 0 0 0 0 0 0 0 0 V3000
- 0.0000 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
+ M V30 BEGIN CTAB
- 0.0000 0.0000 0.0000 AP1 0 0 0 0 0 0 0 0 0 0 0 0
+ M V30 COUNTS 2 1 0 0 0
- 2 1 1 0 0 0 0
+ M V30 BEGIN ATOM
+ M V30 1 N 0.0 0.0 0.0 0
+ M V30 2 AP1 0.0 0.0 0.0 0
+ M V30 END ATOM
+ M V30 BEGIN BOND
+ M V30 1 1 2 1
+ M V30 END BOND
+ M V30 BEGIN COLLECTION
+ M V30 MDLV30/HILITE BONDS=(1 1)
+ M V30 END COLLECTION
+ M V30 END CTAB
+ M V30 BEGIN COLLECTION
+ M V30 MDLV30/HILITE BONDS=(1 1)
+ M V30 END COLLECTION
- 2 1 0 0 0 0 0 0 0 0999 V2000
+ 0 0 0 0 0 0 0 0 0 0 0 V3000
- 0.0000 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
+ M V30 BEGIN CTAB
- 0.0000 0.0000 0.0000 AP1 0 0 0 0 0 0 0 0 0 0 0 0
+ M V30 COUNTS 2 1 0 0 0
- 2 1 1 0 0 0 0
+ M V30 BEGIN ATOM
+ M V30 1 N 0.0 0.0 0.0 0
+ M V30 2 AP1 0.0 0.0 0.0 0
+ M V30 END ATOM
+ M V30 BEGIN BOND
+ M V30 1 1 2 1
+ M V30 END BOND
+ M V30 BEGIN COLLECTION
+ M V30 MDLV30/HILITE BONDS=(1 1)
+ M V30 END COLLECTION
+ M V30 END CTAB
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