Addresses SEGV in #106 (#107)

But it doesn't address the root issue of NaN coordinates.
schrodinger · Jan 5, 2022 · 3ec1dfc · 3ec1dfc
1 parent faa3273
commit 3ec1dfc
Showing 1 changed file with 1 addition and 0 deletions.
diff --git a/sketcherMinimizerAtom.cpp b/sketcherMinimizerAtom.cpp
@@ -360,6 +360,7 @@ sketcherMinimizerAtom::clockwiseOrderedNeighbors() const
 
     while (!neighs.empty()) {
         float smallestAngle = 361;
+        lastPoppedIndex = 0;
         for (unsigned int i = 0; i < neighs.size(); i++) {
             float newAngle = sketcherMinimizerMaths::signedAngle(
                 lastPoppedAtom->coordinates, coordinates,