Commit Graph

608 Commits

Author SHA1 Message Date
e840fa23f1 Add format-tests target 2020-06-15 11:21:43 -04:00
b5ee87697a workaround for GNU Fortran 10 and later when compiling downloaded ScaFaCoS lib 2020-06-15 10:59:32 -04:00
49982e22bf Add check for permissions 2020-06-13 09:54:12 -04:00
fcd3e9a3f9 Make quiet Python 3 check 2020-06-13 08:40:27 -04:00
ec6d3586ce require at least python 3.5 for building docs and import CMake improvements from progguide branch 2020-06-13 01:20:24 -04:00
cf5fa3959c Add first version of whitespace utility 2020-06-12 21:52:51 -04:00
1a1cc99144 use correct expression for source folder. small output tweak. 2020-06-10 12:41:20 -04:00
6891fa2610 update a few URLs to use https: instead of http: 2020-06-10 12:34:09 -04:00
f36a84bdd3 add CMake support for fetching external potential files 2020-06-10 12:29:48 -04:00
78f030a07a test for *cubin.h files in lib/gpu that conflict with cmake compilation 2020-06-09 07:32:49 -04:00
2a4bd9ef53 small tweaks and documentation update to coverage cleaning targets 2020-05-29 08:33:34 -04:00
30020594df add custom target to remove/reset collected coverage data 2020-05-29 08:23:25 -04:00
0c503ab122 Move coverage html into folder 2020-05-29 08:23:08 -04:00
042cfc521b cmake: allow to overwrite GTest URL for offline machines 2020-05-24 19:38:19 -06:00
8691579def Merge pull request #2098 from lammps/unittest
Add first part of an integrated unit test framework
2020-05-20 15:44:52 -04:00
58ca1dcf8e Merge pull request #2094 from akohlmey/collected-small-changes
Collected small changes and bug fixes for the next patch release
2020-05-20 14:33:34 -04:00
c04a71a239 add unit test framework for pair, bond, angle styles from progguide branch 2020-05-19 22:24:31 -04:00
48a9e0d732 consolidate setting CMake policy CMP0074 into main cmake file 2020-05-19 15:20:41 -04:00
16db223d03 update test for whether to set CMake policy CMP0074 is needed. 2020-05-19 11:53:47 -04:00
93fe33553a need to set CMake policy CMP0074 to NEW behavior also for finding TBB Malloc 2020-05-18 17:50:28 -04:00
6f0a56c176 cmake: fftw is now a private dep 2020-05-15 13:42:51 -06:00
cbd4ce5130 Use absolute path to LAMMPS_DIR for collecting git info 2020-05-08 16:04:55 -04:00
3b77546eb9 Merge pull request #2069 from junghans/latte_v1.2.2
latte: bump to v1.2.2
2020-05-07 14:27:19 -04:00
5fa7e138ea Merge pull request #2070 from junghans/kokkos_v3.1.01
cmake: bump kokkos to v3.1.01
2020-05-07 14:16:56 -04:00
66994562e6 cmake: bump kokkos to v3.1.01 2020-05-05 11:46:09 -06:00
fe62e1dbc9 latte: bump to v1.2.2 2020-05-05 10:51:11 -06:00
b933538dfa tweak tbbmalloc search path for intel 19.1 compiler 2020-05-05 11:27:19 -04:00
71ab9dc02b Merge pull request #2049 from rbberger/singularity_container_update
Singularity container update
2020-05-04 17:27:54 -04:00
fdb4ba51da add patch to VORONOI package external build so it will compile with BSD make 2020-05-03 04:04:02 -04:00
696308a760 set cmake policy to honor HDF5_ROOT and NETCDF_ROOT. search for parallel NetCDF only with parallel builds 2020-04-29 22:39:33 -04:00
1adda03202 cmake: only install shared lib and friends 2020-04-29 18:06:33 -06:00
ef3e071067 GPU.cmake: localize hackery 2020-04-28 07:43:31 -06:00
6be36196da explicitly include STUBS MPI headers for serial compile since we seem to pick up the OpenMP ones otherwise 2020-04-28 01:36:21 -04:00
705c10ef47 restore original command 2020-04-28 01:12:49 -04:00
d3017744a9 updates for building with hip 2020-04-28 00:39:11 -04:00
29d667721a tweak GPU.cmake so that hip_get_devices compiles and links 2020-04-27 22:29:41 -04:00
5006c2c329 Merge branch 'latte_super_build' of github.com:junghans/lammps into collected-small-changes 2020-04-27 21:19:45 -04:00
74e8505a1f Merge branch 'master' into collected-small-changes 2020-04-27 16:57:47 -04:00
0f28e0eb0f Merge pull request #2030 from lammps/revert-2018-cmake_kim-api_find
Revert "cmake: move kim-api detection to cmake config"
2020-04-27 16:16:55 -04:00
0a9bed0ca6 Merge branch 'cmake_clean_up_plumed' of github.com:junghans/lammps into collected-small-changes 2020-04-27 16:07:52 -04:00
281c105a34 KIM.cmake: add workaround for <cmake-3.12 2020-04-26 12:02:18 -06:00
d092b24c2e Revert "cmake: move kim-api detection to cmake config" 2020-04-26 11:56:48 -06:00
9a5b7141af move MPI compilation variable definitions workaround to MPI4WIN.cmake 2020-04-26 00:14:27 -04:00
7fd50045fe USER-PLUMED: remove unused defines 2020-04-25 10:16:58 -06:00
5308b00c7b Update LATTE.cmake 2020-04-25 07:28:16 -06:00
bac681b9dc cmake: fix linkage against external latte 2020-04-24 20:51:58 -06:00
72ff0dd87d Merge pull request #2004 from stanmoore1/kk_3.1
Update Kokkos library in LAMMPS to v3.1
2020-04-24 18:35:53 -04:00
4890c328d9 add comment to trigger jenkins rerun 2020-04-24 13:21:38 -04:00
68dd6d0f19 cmake: move kim-api detection to cmake config 2020-04-23 09:20:38 -06:00
623f03e322 cmake: add support for latte super-build 2020-04-22 14:21:34 -06:00