Changeset 53d153 for molecuilder/src/boundary.hpp

Timestamp:

Jul 27, 2009, 8:16:03 AM (16 years ago)

Author:

Frederik Heber <heber@…>

Children:

0ac84df

Parents:

c3a303

Message:

Split VolumeOfConvexEnvelope() into find_convex_border() and remainder.

• Convex envelope is not working anymore, in the state of fixing it and trying to refactor code a bit.
• planned to have VolumeOfConvexEnvelope() to be replaced by VolumeOfEnvelope(), which can also do Non-Convex-Envelopes

File:

• molecuilder/src/boundary.hpp (modified) (2 diffs)

molecuilder/src/boundary.hpp

@@ -93 +93 @@
     ~Tesselation();
 
-    void TesselateOnBoundary(ofstream *out, config *configuration, molecule *mol);
+    void TesselateOnBoundary(ofstream *out, molecule *mol);
     void GuessStartingTriangle(ofstream *out);
     void AddPoint(atom * Walker);
@@ -124 +124 @@
 
 
-double VolumeOfConvexEnvelope(ofstream *out, const char *filename, config *configuration, Boundaries *BoundaryPoints, molecule *mol);
+double VolumeOfConvexEnvelope(ofstream *out, class Tesselation *TesselStruct, class config *configuration);
 double * GetDiametersOfCluster(ofstream *out, Boundaries *BoundaryPtr, molecule *mol, bool IsAngstroem);
 void PrepareClustersinWater(ofstream *out, config *configuration, molecule *mol, double ClusterVolume, double celldensity);
+void Find_convex_border(ofstream *out, molecule* mol, class Tesselation *&TesselStruct, class LinkedCell *LCList, const char *filename);
 void Find_non_convex_border(ofstream *out, molecule* mol, class Tesselation *T, class LinkedCell *LC, const char *tempbasename, const double RADIUS);
 void Find_next_suitable_point(class BoundaryTriangleSet *BaseTriangle, class BoundaryLineSet *BaseLine, atom*& OptCandidate, Vector *OptCandidateCenter, double *ShortestAngle, const double RADIUS, LinkedCell *LC);