[ViewVC] Diff of: OpenMD/trunk/src/openbabel/povrayformat.cpp

Comparing trunk/src/openbabel/povrayformat.cpp (file contents):
Revision 746 by tim, Wed Nov 16 21:22:51 2005 UTC vs.
Revision 1081 by gezelter, Thu Oct 19 20:49:05 2006 UTC

+GNU General Public License for more details.
+***********************************************************************/
-<
+#include "povrayformat.hpp"
->
+/* ---- C includes ---- */
->
+#include <math.h>
->
+#include <time.h>
->
+#include <stdlib.h>
-+
+/* ---- OpenBabel include ---- */
-+
+#include "config.h"
-+
+#include "mol.hpp"
-+
+#include "obconversion.hpp"
-+
-+
+/* ---- C++ includes ---- */
-+
+#include <string>
-+
+#if defined(HAVE_SSTREAM)
-+
+#include <sstream>
-+
+#else
-+
+#include <strstream>
-+
+#endif
-+
-+
+/* ---- Max. length of a atom-label ---- */
-+
+#define StrLen 32
-+
-+
+/* ---- Define max. length of domainname ---- */
-+
+#define MAXDOMAINNAMELEN 256
-+
-+
+/* ---- Maximal radius of an atom. Needed for bounding box ---- */
-+
+#define MAXRADIUS (double) 3.0
-+
-+
+/* ---- Define index of first atom if needed ---- */
-+
+#ifndef MIN_ATOM
-+
+#define MIN_ATOM 1
-+
+#endif
-+
-+
+/* ---- Size of time-string ---- */
-+
+#define TIME_STR_SIZE 64
-+
-+
+/* ---- if x < = EPSILON then x = 0.0 ---- */
-+
+#define EPSILON (double) 1e-4
-+
-+
+/* ---- Define makro for calculating x^2 ---- */
-+
+#ifdef SQUARE
-+
+#undef SQUARE
-+
+#endif
-+
+#define SQUARE(x) ((x) * (x))
-+
-+
+/* ---- Define PI (if needed) ---- */
-+
+#ifndef PI
-+
+#define PI ((double) 3.1415926535897932384626433)
-+
+#endif
-+
-+
+/* ---- Convert RAD to DEG ---- */
-+
+#define RAD2DEG(r) (((double) 180.0 * r) / PI)
-+
+using namespace std;
+namespace OpenBabel
-+
+{
-+
-+
+class PovrayFormat : public OBFormat
-+
+public:
-+
+    //Register this format type ID
-+
+    PovrayFormat()
-+
+    {
-+
+        OBConversion::RegisterFormat("pov",this);
-+
+    }
-+
-+
+    virtual const char* Description() //required
-+
+    {
-+
+        return
-+
+            "POV-Ray input format\n \
-+
+            No comments yet\n";
-+
+    };
-+
-+
+  virtual const char* SpecificationURL()
-+
+  {return "http://www.povray.org/";}; //optional
-+
-+
+    //Flags() can return be any the following combined by | or be omitted if none apply
-+
+    // NOTREADABLE  READONEONLY  NOTWRITABLE  WRITEONEONLY
-+
+    virtual unsigned int Flags()
-+
+    {
-+
+        return NOTREADABLE | WRITEONEONLY;
-+
+    };
-+
-+
+    ////////////////////////////////////////////////////
-+
+    /// The "API" interface functions
-+
+    virtual bool WriteMolecule(OBBase* pOb, OBConversion* pConv);
-+
+    ////////////////////////////////////////////////////
-+
+    /// The "Convert" interface functions
-+
+    virtual bool WriteChemObject(OBConversion* pConv)
-+
+    {
-+
+        //Retrieve the target OBMol
-+
+        OBBase* pOb = pConv->GetChemObject();
-+
+        OBMol* pmol = dynamic_cast<OBMol*> (pOb);
-+
+        bool ret=false;
-+
+        if(pmol)
-+
+            ret=WriteMolecule(pmol,pConv);
-+
+        std::string auditMsg = "OpenBabel::Write molecule ";
-+
+        std::string description(Description());
-+
+        auditMsg += description.substr( 0, description.find('\n') );
-+
+        obErrorLog.ThrowError(__func__,
-+
+                              auditMsg,
-+
+                              obAuditMsg);
-+
+        delete pOb;
-+
+        return ret;
-+
+    };
-+
+};
-+
-+
+//Make an instance of the format class
-+
+PovrayFormat thePovrayFormat;
-+
+/* ---- Make a prefix from title of molecule ---- */
+string MakePrefix(const char* title)

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Comparing trunk/src/openbabel/povrayformat.cpp (file contents): Revision 746 by tim, Wed Nov 16 21:22:51 2005 UTC vs. Revision 1081 by gezelter, Thu Oct 19 20:49:05 2006 UTC

Diff Legend

Comparing trunk/src/openbabel/povrayformat.cpp (file contents):
Revision 746 by tim, Wed Nov 16 21:22:51 2005 UTC vs.
Revision 1081 by gezelter, Thu Oct 19 20:49:05 2006 UTC