Commit Graph

6 Commits

Author SHA1 Message Date
Jan Eitzinger
3d0f4b97ee Switch copyright header in source files. 2022-09-05 10:39:42 +02:00
Rafael Ravedutti
939197a785 Create separate structs DeviceAtom and DeviceNeighbor with device pointers
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-08-12 17:28:06 +02:00
Rafael Ravedutti
87d006d418 Fix GPU version
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-08-11 16:42:41 +02:00
Rafael Ravedutti
c18124b066 Integrate LAMMPS CUDA versions into master branch
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-08-09 18:53:53 +02:00
Rafael Ravedutti
814f561993 Allow PBC in just some directions
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-07-08 02:30:03 +02:00
Rafael Ravedutti
aa0f4048d0 Rename default directory to lammps and reorganize gromacs variant steps
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-01-25 21:00:11 +01:00