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fix sf.net bug 1836242: "Bug in AtomType definition for Carbon_Polar"

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Greg Landrum
2007-11-22 05:25:36 +00:00
parent 807588b011
commit 267a6ca684
1 changed files with 2 additions and 2 deletions
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4
Data/BaseFeatures.fdef
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@@ -144,8 +144,8 @@ EndFeature
# any carbon that is not bonded to a polar atom is considered a hydrophobe
#
# generic non-polar carbon atom
AtomType Carbon_Polar [$([#6][#7,#8,#9])]
AtomType Carbon_NonPolar [#6;!{Carbon_Polar}]
AtomType Carbon_Polar [#6;$([#6]~[#7,#8,#9])]
AtomType Carbon_NonPolar [#6;+0;!{Carbon_Polar}]
DefineFeature ThreeWayAttach [D3,D4;{Carbon_NonPolar}]
Family Hydrophobe