Changeset 5063f1 for molecuilder

Timestamp:

May 26, 2008, 1:22:10 PM (17 years ago)

Author:

Frederik Heber <heber@…>

Children:

38c017

Parents:

23c207

Message:

bit more verbosity on the FragmentNumber

File:

• molecuilder/src/moleculelist.cpp (modified) (3 diffs)

molecuilder/src/moleculelist.cpp

@@ -202 +202 @@
   atom *Walker = NULL;
   vector BoxDimension;
-  char *FragmentNumber;
+  char *FragmentNumber = NULL;
   int FragmentCounter = 0;
   ofstream output;
@@ -218 +218 @@
     sprintf(FragmentName, "%s/%s%s.conf.xyz", configuration->configpath, FRAGMENTPREFIX, FragmentNumber);
     outputFragment.open(FragmentName, ios::out);
-    *out << Verbose(2) << "Saving bond fragment No. " << FragmentNumber << " as XYZ ...";
+    *out << Verbose(2) << "Saving bond fragment No. " << FragmentNumber << "/" << FragmentCounter-1 << " as XYZ ...";
     if (intermediateResult = ListOfMolecules[i]->OutputXYZ(&outputFragment))
       *out << " done." << endl;
@@ -257 +257 @@
     // change path in config
     configuration->SetDefaultPath(FragmentName);
-    *out << Verbose(2) << "Saving bond fragment No. " << FragmentNumber << " as config ...";
+    *out << Verbose(2) << "Saving bond fragment No. " << FragmentNumber << "/" << FragmentCounter-1 << " as config ...";
     if (intermediateResult = configuration->Save(&outputFragment, ListOfMolecules[i]->elemente, ListOfMolecules[i]))
       *out << " done." << endl;