| commit | 39566cbfcc728d30750c534d1f12917ff35aafc3 | |
| author | Berk Hess <hess@kth.se> | |
| Tue, 10 Sep 2019 09:01:19 +0000 (10 11:01 +0200) | ||
| committer | Magnus Lundborg <magnus.lundborg@scilifelab.se> | |
| Thu, 12 Sep 2019 09:15:57 +0000 (12 11:15 +0200) | ||
| tree | 5b59c5eb65bbb2da6d055dd81a888cf1e639e20f | treesnapshot (tar.gz zip) |
| parent | 85696d4529880365df48c56ed316d518db39d3c7 | commitdiff |
Enable TPI with the Verlet cut-off scheme
This requires a special treatment for the nbnxm gridding and search,
with one grid for the system to insert in and one grid for
the molecule to insert.
Also reenabled the TPI tests.
Change-Id: Ia3888daf4b06a94b0a7a03ec17b7bbe27084ac3d
This requires a special treatment for the nbnxm gridding and search,
with one grid for the system to insert in and one grid for
the molecule to insert.
Also reenabled the TPI tests.
Change-Id: Ia3888daf4b06a94b0a7a03ec17b7bbe27084ac3d
18 files changed: