[ViewVC] Diff of: group/trunk/OOPSE/libmdtools/ReadWrite.hpp

Comparing:
branches/mmeineke/OOPSE/libmdtools/ReadWrite.hpp (file contents), Revision 377 by mmeineke, Fri Mar 21 17:42:12 2003 UTC vs.
trunk/OOPSE/libmdtools/ReadWrite.hpp (file contents), Revision 644 by mmeineke, Tue Jul 22 16:41:08 2003 UTC

#	Line 21 \| Line 21 \| class DumpWriter{ (public)
21		~DumpWriter();
22
23		void writeDump( double currentTime );
24	<	void writeFinal( void );
24	>	void writeFinal( double finalTime );
25
26		private:
27		SimInfo* entry_plug;
#	Line 52 \| Line 52 \| class InitializeFromFile{ (public)
52		InitializeFromFile( char *in_name );
53		~InitializeFromFile();
54
55	<	void read_xyz( SimInfo* the_entry_plug );
55	>	void readInit( SimInfo* the_entry_plug );
56
57		private:
58		char* parseDumpLine(char* line, int atomIndex);
59	+	char* parseBoxLine(char* line, double boxMat[9], double &time );
60		FILE *c_in_file;
61		char c_in_name[500];
62	<	SimInfo* entry_plug;
62	>	SimInfo* simnfo;
63		};
64
65	+	class DumpReader{
66
67	+	public:
68	+	DumpReader( char *in_name );
69	+	~DumpReader();
70
71	+	int getNframes();
72	+	void getNextFrame();
73	+	void getFrame(SimInfo* the_entry_plug, int whichFrame);
74	+	void rewind();
75	+
76	+	private:
77	+	char* parseDumpLine(char* line, int atomIndex);
78	+	char* parseCommentLine(char* line, double &time, double boxMat[9] );
79	+	FILE *c_in_file;
80	+	char c_in_name[500];
81	+	SimInfo* simnfo;
82	+	};
83	+
84	+
85	+
86		#endif

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