samples/gbljtest/gb.md

#ifndef __GB_MD__
#define __GB_MD__

molecule{
  name = "GB";
  
  atom[0]{
     type="GBPaper";
     position( 0.0, 0.0, 0.0 );
     orientation(0.0,0.0,0.0);
  }
}
molecule{
  name = "GBlinear";
  
  atom[0]{
     type="GBlinear";
     position( 0.0, 0.0, 0.0 );
     orientation(0.0,0.0,0.0);
  }
}
#endif
Revision:	983
Committed:	Tue Jun 6 17:43:28 2006 UTC (18 years, 11 months ago) by gezelter
File size:	309 byte(s)
Log Message:	testing GB, removing CM drift in Langevin Dynamics, fixing a memory leak, adding a visitor
#	User	Rev	Content
1	gezelter	671	#ifndef __GB_MD__
2			#define __GB_MD__
3
4			molecule{
5			name = "GB";
6	tim	790
7	gezelter	671	atom[0]{
8	gezelter	685	type="GBPaper";
9	gezelter	671	position( 0.0, 0.0, 0.0 );
10			orientation(0.0,0.0,0.0);
11			}
12			}
13			molecule{
14	gezelter	983	name = "GBlinear";
15	tim	790
16	gezelter	671	atom[0]{
17	gezelter	983	type="GBlinear";
18	gezelter	671	position( 0.0, 0.0, 0.0 );
19			orientation(0.0,0.0,0.0);
20			}
21			}
22			#endif