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update a couple definitions so that we do not match ring atoms

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Greg Landrum
2009-11-01 09:26:44 +00:00
parent e42fedae0d
commit 88ea8788b3
1 changed files with 4 additions and 4 deletions
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8
Data/FunctionalGroups.txt
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@@ -21,10 +21,10 @@
//--------------------------------------------------
// Nitrogen containing
-NO2 *-[N;D3](=[O;D1])[O;D1] nitro
-N=O *-N=[O;D1] nitroso
=N-O *=N-[O;D1] oximes
=NCH3 *=N-[C;D1;H3] Imines
-N=CH2 *-N=[C;D1;H2] Imines
-N=O *-[N;R0]=[O;D1] nitroso
=N-O *=[N;R0]-[O;D1] oximes
=NCH3 *=[N;R0]-[C;D1;H3] Imines
-N=CH2 *-[N;R0]=[C;D1;H2] Imines
-N=NCH3 *-[N;D2]=[N;D2]-[C;D1;H3] terminal azo
-N=N *-[N;D2]=[N;D1] hydrazines
-N#N *-[N;D2]#[N;D1] diazo