[ViewVC] Diff of: group/trunk/OOPSE-3.0/samples/water/ssdrf/water.md

Comparing trunk/OOPSE-3.0/samples/water/ssdrf/water.md (file contents):
Revision 2396 by chrisfen, Thu Oct 6 18:44:32 2005 UTC vs.
Revision 2397 by chrisfen, Wed Oct 26 23:30:52 2005 UTC

+molecule{
-+
+  name = "PAIR";
-+
+  nAtoms = 3;
-+
+  atom[0]{
-+
+    type = "Pchg+";
-+
+    position(0.0, 1, 1.0);
-+
+  }
-+
+  atom[1]{
-+
+    type = "Pchg+";
-+
+    position(0.0, -1, 1.0);
-+
+  }
-+
+  atom[2]{
-+
+    type = "Pchg-";
-+
+    position(0.0, 0.0, -1.0);
-+
+  }
-+
-+
+  nRigidBodies = 1;
-+
+  rigidBody[0]{
-+
+    nMembers = 3;
-+
+    members(0, 1, 2);
-+
+  }
-+
-+
+  nCutoffGroups = 1;
-+
+  cutoffGroup[0]{
-+
+    nMembers = 3;
-+
+    members(0, 1, 2);
-+
+  }
-+
+}
-+
-+
+molecule{
-+
+  name = "PDIP";
-+
+  nAtoms = 1;
-+
+  atom[0]{
-+
+    type = "PDIP";
-+
+    position( 0.0, 0.0, 0.0 );
-+
+    orientation( 0.0, 0.0, 0.0 );
-+
+  }
-+
+}
-+
-+
+molecule{
+  name = "SSD_E";
+  nAtoms = 1;
+  atom[0]{

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+Removed lines
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+Changed lines
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+Changed lines