| Revision: | 2370 |
| Committed: | Fri Oct 14 16:43:02 2005 UTC (18 years, 9 months ago) by gezelter |
| File size: | 322 byte(s) |
| Log Message: | Adding .md files for GB/LJ tests |
| # | User | Rev | Content |
|---|---|---|---|
| 1 | gezelter | 2370 | #ifndef __GB_MD__ |
| 2 | #define __GB_MD__ | ||
| 3 | |||
| 4 | molecule{ | ||
| 5 | name = "GB"; | ||
| 6 | nAtoms = 1; | ||
| 7 | atom[0]{ | ||
| 8 | type="GB"; | ||
| 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 |