[Cdk-devel] [ cdk-Bugs-942345 ] Descreasing number of spheres confuses HOSE code

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Bugs item #942345, was opened at 2004-04-26 16:11
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Category: org.openscience.cdk.tools
Group: None
Status: Open
Resolution: None
Priority: 5
Submitted By: Stefan Kuhn (shk3)
Assigned to: Nobody/Anonymous (nobody)
Summary: Descreasing number of spheres confuses HOSE code

Initial Comment:
Consider the attaches molecule. Creating hose codes for
atom 6 in cdk numbering with spheres 6 to 1 gives
theses HOSE codes. Clearly the created spheres are not
the same

C-4;CCCC(C=N,CC,*C*C,C/CHN,&,&HC,=OO,&*C,*C,&/&,,C&,,=C&,,C,*C,*&),&,C,,*&/,/
C-4;CCCC(C=N,CC,*C*C,C/CHN,&,&HC,=OO,*C&,*C,&/&,,C&,,=C&,,C,*C,*&),&,C,,*&/
C-4;CCCC(CC,C=N,*C*C,C/HCC,=OO,HN&,&,*C&,*C,&/,=CC,&,,C,,&&,*C,*&)
C-4;CCCC(CC,C=N,*C*C,C/HCC,=OO,H&N,&,*C&,*C,&/)
C-4;CCCC(*C*C,=NC,CC,C//)
C-4;CCCC(//)

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