| Revision: | 2384 |
| Committed: | Tue Oct 18 21:13:33 2005 UTC (18 years, 9 months ago) by gezelter |
| File size: | 327 byte(s) |
| Log Message: | added a few GB test cases |
| # | Content |
|---|---|
| 1 | #ifndef __GB_MD__ |
| 2 | #define __GB_MD__ |
| 3 | |
| 4 | molecule{ |
| 5 | name = "GB"; |
| 6 | nAtoms = 1; |
| 7 | atom[0]{ |
| 8 | type="GBPaper"; |
| 9 | position( 0.0, 0.0, 0.0 ); |
| 10 | orientation(0.0,0.0,0.0); |
| 11 | } |
| 12 | } |
| 13 | molecule{ |
| 14 | name = "linear"; |
| 15 | nAtoms = 1; |
| 16 | atom[0]{ |
| 17 | type="linear"; |
| 18 | position( 0.0, 0.0, 0.0 ); |
| 19 | orientation(0.0,0.0,0.0); |
| 20 | } |
| 21 | } |
| 22 | #endif |