| commit | ca3084144ed75f1ec67fe56312e56cbe45da6080 | |
| author | Berk Hess <hess@kth.se> | |
| Sun, 29 Jun 2014 09:31:14 +0000 (29 11:31 +0200) | ||
| committer | Gerrit Code Review <gerrit@gerrit.gromacs.org> | |
| Sun, 29 Jun 2014 15:24:07 +0000 (29 17:24 +0200) | ||
| tree | 14c3eeca9e58a6cb90da7e16c634b73448c20e85 | treesnapshot (tar.gz zip) |
| parent | fc819eee87572d5608778642bcf22badaf3b4361 | commitdiff |
Take LJ-PME into account for table spacing
The table spacing for the grid correction for Ewald interactions
only took Coulomb and not LJ into account. Note that with default
settings LJ tables can use a coarser spacing than Coulomb.
Change-Id: Ib0f831a2177bcf10ad9e03c6764cc155e89abdbb
The table spacing for the grid correction for Ewald interactions
only took Coulomb and not LJ into account. Note that with default
settings LJ tables can use a coarser spacing than Coulomb.
Change-Id: Ib0f831a2177bcf10ad9e03c6764cc155e89abdbb
| src/gromacs/legacyheaders/tables.h | diffblobblamehistory | |
| src/gromacs/mdlib/forcerec.c | diffblobblamehistory | |
| src/gromacs/mdlib/tables.c | diffblobblamehistory |