| commit | 68ec0470ab5fe89c8c774ecff65da5fb919bcb03 | |
| author | Berk Hess <hess@kth.se> | |
| Mon, 14 May 2018 13:55:36 +0000 (14 15:55 +0200) | ||
| committer | Mark Abraham <mark.j.abraham@gmail.com> | |
| Wed, 13 Jun 2018 12:40:27 +0000 (13 14:40 +0200) | ||
| tree | c0e418d5dbb05d1a498a5b0d05a5d1ee72f6195c | treesnapshot (tar.gz zip) |
| parent | f3410c301f5af50714823f6f00ddf43e4c94ada2 | commitdiff |
Partial conversion of gmx_domdec_t to C++
Most of the simple buffers in gmx_domdec_t now use std::vector.
Changed AtomDistribution to use std::unique_ptr.
Now new is used for gmx_domdec_t with some default zero values.
Renamed charge groups to atom groups for all modified code
in preparation for the introduction of update groups.
Change-Id: Ie54b2e6fc354cd2fbc874023922369261b3cd092
Most of the simple buffers in gmx_domdec_t now use std::vector.
Changed AtomDistribution to use std::unique_ptr.
Now new is used for gmx_domdec_t with some default zero values.
Renamed charge groups to atom groups for all modified code
in preparation for the introduction of update groups.
Change-Id: Ie54b2e6fc354cd2fbc874023922369261b3cd092
17 files changed: