| Revision: | 2802 |
| Committed: | Tue Jun 6 17:43:28 2006 UTC (18 years, 1 month 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 | 2370 | #ifndef __GB_MD__ |
| 2 | #define __GB_MD__ | ||
| 3 | |||
| 4 | molecule{ | ||
| 5 | name = "GB"; | ||
| 6 | tim | 2489 | |
| 7 | gezelter | 2370 | atom[0]{ |
| 8 | gezelter | 2384 | type="GBPaper"; |
| 9 | gezelter | 2370 | position( 0.0, 0.0, 0.0 ); |
| 10 | orientation(0.0,0.0,0.0); | ||
| 11 | } | ||
| 12 | } | ||
| 13 | molecule{ | ||
| 14 | gezelter | 2802 | name = "GBlinear"; |
| 15 | tim | 2489 | |
| 16 | gezelter | 2370 | atom[0]{ |
| 17 | gezelter | 2802 | type="GBlinear"; |
| 18 | gezelter | 2370 | position( 0.0, 0.0, 0.0 ); |
| 19 | orientation(0.0,0.0,0.0); | ||
| 20 | } | ||
| 21 | } | ||
| 22 | #endif |