Correct bug in GetInchi

CFGrote · Oct 31, 2008 · 03a7b1c · 03a7b1c
1 parent f33dd39
commit 03a7b1c
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diff --git a/ChangeLog b/ChangeLog
@@ -1,3 +1,8 @@
+2008-10-31  Chris Morley
+
+	* src/formats/getinchi.cpp: prevent failure when input contains
+	"InChI>InChI=...", which actually occurred in an SDF file.
+
 2008-10-27  Chris Morley
 
 	* mcdlutil.cpp: Replace all calls to fabs with abs. 

diff --git a/src/formats/getinchi.cpp b/src/formats/getinchi.cpp
@@ -234,6 +234,7 @@ string GetInChI(istream& is)
         }
         else
         {
+          is.unget(); //It may be the start of a real "InChI="
           result.erase();
           state = before_inchi;
         }
-Original file line number
+Diff line change
@@ Expand Up / @@ -234,6 +234,7 @@ string GetInChI(istream& is) @@
             }
             else
             {
+              is.unget(); //It may be the start of a real "InChI="
               result.erase();
               state = before_inchi;
             }
@@ Expand Down @@