| 1 |
+ |
2004-04-15 17:15 tim |
| 2 |
+ |
|
| 3 |
+ |
* libmdtools/SimSetup.cpp, utils/zsub.cpp: fix a bug in setting |
| 4 |
+ |
exclude list |
| 5 |
+ |
|
| 6 |
+ |
2004-04-15 11:18 tim |
| 7 |
+ |
|
| 8 |
+ |
* ChangeLog, forceFields/DUFF.frc, libBASS/MoleculeStamp.cpp, |
| 9 |
+ |
libmdtools/Atom.hpp, libmdtools/InitializeFromFile.cpp, |
| 10 |
+ |
libmdtools/Integrator.cpp, libmdtools/Molecule.cpp, |
| 11 |
+ |
libmdtools/RigidBody.cpp, libmdtools/RigidBody.hpp, |
| 12 |
+ |
libmdtools/SimInfo.cpp, libmdtools/SimSetup.cpp, |
| 13 |
+ |
libmdtools/Thermo.cpp, libmdtools/WATER.cpp, |
| 14 |
+ |
libmdtools/calc_charge_charge.F90, libmdtools/do_Forces.F90: fix |
| 15 |
+ |
whole bunch of bugs :-) |
| 16 |
+ |
|
| 17 |
|
2004-04-14 12:20 chrisfen |
| 18 |
|
|
| 19 |
|
* forceFields/WATER.frc: Added the WATER.frc force field |
| 2966 |
|
libmdtools/mpiSimulation.hpp, libmdtools/mpiSimulation_module.F90, |
| 2967 |
|
libmdtools/neighborLists.F90, libmdtools/randomSPRNG.cpp, |
| 2968 |
|
libmdtools/randomSPRNG.hpp, libmdtools/simulation_module.F90, |
| 2969 |
< |
libmdtools/vector_class.F90, libmdtools/wrappers.F90: Initial |
| 2970 |
< |
revision |
| 2969 |
> |
libmdtools/vector_class.F90, libmdtools/wrappers.F90: New OOPSE |
| 2970 |
> |
Tree |
| 2971 |
|
|
| 2972 |
|
2003-03-21 12:42 mmeineke |
| 2973 |
|
|
| 3024 |
|
libmdtools/mpiSimulation.hpp, libmdtools/mpiSimulation_module.F90, |
| 3025 |
|
libmdtools/neighborLists.F90, libmdtools/randomSPRNG.cpp, |
| 3026 |
|
libmdtools/randomSPRNG.hpp, libmdtools/simulation_module.F90, |
| 3027 |
< |
libmdtools/vector_class.F90, libmdtools/wrappers.F90: New OOPSE |
| 3028 |
< |
Tree |
| 3027 |
> |
libmdtools/vector_class.F90, libmdtools/wrappers.F90: Initial |
| 3028 |
> |
revision |
| 3029 |
|
|
