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Update substructure key SMARTS: aromatic 6-ring
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bachi55 authored and johnmay committed Jun 24, 2018
1 parent f47df30 commit d587205
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Original file line number Diff line number Diff line change
Expand Up @@ -110,7 +110,7 @@ MACCS_ID_122: [#7](~*)(~*)~*
MACCS_ID_123: [#8]~[#6]~[#8]
MACCS_ID_124_and_130: [!#6;!#1]~[!#6;!#1]
# Aromatic rings. Original pattern: [!*]
MACCS_ID_125: [aR]1:@a:@a:@a:@a:@a:@1
MACCS_ID_125: a:1:a:a:a:a:a1
MACCS_ID_126: [#8](!@*)!@*
MACCS_ID_127_and_143: [#8]!@[R]@*
MACCS_ID_128: [#6H2](~*~*~*~[#6H2]~*)~*
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