66271448ae
Merge pull request #2167 from Vsevak/master
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Update GPU CMake and Makefile scripts for ROCm v3.5
2020-06-26 13:43:32 -04:00
cd6de39319
whitespace
2020-06-25 15:35:25 -04:00
3525d1f104
simplify suppression handling by creating a custom local file
2020-06-24 13:35:36 -04:00
5ea9b1b38d
simplify detection and application of valgrind suppressions
2020-06-24 09:33:19 -04:00
8cec13a038
Add memory checker support in CMake
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If ENABLE_TESTING is ON, you can now use memory checking tools to run the test
suite and check for memory leaks. By default CMake will try to find valgrind in
your path and set some default options.
To customize this behavior use the MEMORYCHECK_COMMAND and
MEMORYCHECK_COMMAND_OPTIONS variables. To run tests with the memory checker,
use the MemCheck action in ctest:
Run entire test suite:
ctest -T MemCheck
Run single test:
ctest -T MemCheck -R TESTNAME
Run test in verbose mode:
ctest -V -T MemCheck -R TESTNAME
2020-06-23 13:35:59 -04:00
723b9e6760
Try to keep compatibility with deprecated ROCm hcc compiler
2020-06-20 15:17:54 +03:00
2ea5d9956a
find_package is unnecessary for rocprim
2020-06-19 00:01:03 +03:00
d3baa414d2
Fix cmake for GPU ROCm 3.5 backend
2020-06-17 23:33:16 +03:00
2d52a09d08
patch the source code to the ScaFaCoS lib with a proper fix instead of working around it with compiler flags
2020-06-17 13:01:29 -04:00
34e46cc336
add workaround to USER-SCAFACOS package CMake script for linker error in FMM with GNU gcc 10.0
2020-06-17 07:41:00 -04:00
fd8cfed86d
fix typo
2020-06-15 17:33:50 -04:00
14c22a004a
Merge branch 'master' into use-clang-format-demo
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# Conflicts:
# unittest/force-styles/pair_style.cpp
# unittest/utils/test_utils.cpp
2020-06-15 16:14:13 -04:00
4a3d9afb54
Merge pull request #2154 from rbberger/coding_standard
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Add utilities for checking code
2020-06-15 15:32:35 -04:00
0199e369fa
work around race condition and minimizing download attemps for transparently downloaded potential files
2020-06-15 13:46:54 -04:00
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
8691579def
Merge pull request #2098 from lammps/unittest
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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
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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
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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
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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
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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
