Commit Graph

22697 Commits

Author SHA1 Message Date
2321789de0 Merge pull request #1993 from akohlmey/strncmp-update
Use utils::strmatch() in USER-DPD and KOKKOS for safer style matches
2020-04-13 20:44:28 -04:00
c6fe20d93b remove obsoleted file 2020-04-13 20:35:06 -04:00
8962da19ca complete cmake howto 2020-04-13 19:39:00 -04:00
6e4d5fd020 address spelling and other minor issues 2020-04-13 14:34:39 -04:00
e9fdc5e84b rework the debug info section to be more readable and make the options more visible 2020-04-13 14:34:23 -04:00
11b069ffe7 use utils::strmatch() in USER-DPD and KOKKOS for safer style matches 2020-04-13 13:38:38 -04:00
060fa6f68a Merge branch 'master' into simplify_build_choices 2020-04-13 13:00:38 -04:00
61871c3348 Merge pull request #1979 from ohenrich/user-cgdna
USER-CGDNA: Introduced capped force in oxDNA-FENE bonds
2020-04-13 12:59:57 -04:00
6929b3caa3 Merge branch 'collected-small-changes' of github.com:akohlmey/lammps into collected-small-changes 2020-04-13 12:03:27 -04:00
209a3fde71 use MY_PI everywhere, not M_PI. 2020-04-13 12:02:53 -04:00
6c3bb9f511 use MY_PI everywhere, not M_PI. 2020-04-13 11:43:16 -04:00
5d2ec73c5d re-enable cross-compilation with mingw64 2020-04-13 11:22:19 -04:00
74143a3d89 Merge branch 'master' into simplify_build_choices 2020-04-13 11:02:35 -04:00
4abff7b4d3 Merge pull request #1986 from akohlmey/correct-kokkos-docs
Update docs and CMake scripts for Kokkos 3.0+
2020-04-13 11:01:26 -04:00
03634b12df add missing pair style. Coulombic/Coulombics -> Coulomb for consistency 2020-04-13 10:38:09 -04:00
29f9ca4b54 use list-table and figure to have side-by-side images 2020-04-13 10:30:01 -04:00
f159c57f08 Adding square roots to inf norm instances in min.cpp 2020-04-13 08:15:59 -06:00
38343f3c03 C2 JT 041320
- removing a commented line
2020-04-13 08:05:06 -06:00
8fabd79440 Commit JT 041320
- corrected pair/spin to recover tests
2020-04-13 07:53:27 -06:00
394c906979 Merge branch 'master' into user-cgdna 2020-04-13 10:40:55 +01:00
fbce1a8549 write initial part of CMake tutorial 2020-04-12 21:39:19 -04:00
ebf6e23a67 explain error message when using a non-c++11 compliant compiler. 2020-04-12 16:32:40 -04:00
3201213bec remove tabs 2020-04-12 16:32:16 -04:00
5bb2449ddb provide info about including debug support in executable and a stack trace debug tutorial 2020-04-12 15:34:00 -04:00
5584bd1106 Update traditional make info and synchronize information provided with CMake version 2020-04-12 11:41:25 -04:00
8b1c6cb279 Merge branch 'omp4-compat' into correct-kokkos-docs 2020-04-12 01:44:47 -04:00
111ceb24cf Merge branch 'simplify_build_choices' of github.com:akohlmey/lammps into simplify_build_choices 2020-04-12 01:39:47 -04:00
17fdf976b0 must force non-interactive setup 2020-04-12 01:35:41 -04:00
9cf6c72a9c fix spell-checker issues 2020-04-12 00:36:39 -04:00
82b767f6bd Merge pull request #1 from akohlmey/omp4-compat
Update OpenMP 4+ compatibility pull request for LAMMPS
2020-04-11 22:21:41 -04:00
7b3b77226e update build overview 2020-04-11 22:20:35 -04:00
fa0cc2c217 update singularity definition files 2020-04-11 21:36:08 -04:00
5542ad31dc Merge branch 'master' into simplify_build_choices
# Conflicts:
#	cmake/Modules/Packages/GPU.cmake
2020-04-11 21:31:07 -04:00
d6624fe444 Merge pull request #1863 from Vsevak/gpu_hip
HIP back end to GPU package to support AMD GPUs via the ROCm toolkit
2020-04-11 21:14:45 -04:00
2edc6939a8 update and correct docs for OpenMP 3.x vs OpenMP 4.x and how to work around it. 2020-04-11 18:51:10 -04:00
3fa7265ff8 modernize CMake script code and add version tests for Clang and Intel to switch to OpenMP4 semantics 2020-04-11 18:35:37 -04:00
7a16567e2a better version info output with intel compilers 2020-04-11 18:34:37 -04:00
4acdd161f0 Merge pull request #1937 from jibril-b-coulibaly/fixadapt
fix adapt: implement scale keyword for diameter/charge and 2d compatibility
2020-04-11 17:31:13 -04:00
832cb57d91 Merge branch 'master' into fixadapt
# Conflicts:
#	doc/src/fix_adapt.rst
2020-04-11 16:24:13 -04:00
35bb597747 fix some whitespace issues: replace tabs with spaces, remove DOS/Windows style CR-LF 2020-04-11 16:11:27 -04:00
15314e3c95 Merge branch 'patch-1' of github.com:LunarLanding/lammps into correct-kokkos-docs 2020-04-11 15:41:14 -04:00
8407a77893 add text segments removed from other pages. 2020-04-11 12:43:50 -04:00
d50013ed16 complete rewrite of the CMake build overview page 2020-04-11 12:43:31 -04:00
15c89c388b add link target 2020-04-11 12:43:00 -04:00
60910e64f1 Fix typo in latex formula (cosine was not squared)
What the title says; I am assuming it is squared in the implementation.
2020-04-11 17:17:48 +01:00
e9af15ebb4 start rewrite of the cmake with LAMMPS documentation 2020-04-11 11:55:45 -04:00
c0d3ecfff0 start more detailed CMake howto document 2020-04-11 11:55:13 -04:00
20edc12821 copy images from figure rst directives as well 2020-04-11 11:53:55 -04:00
7978d20352 tweaks 2020-04-11 02:02:15 -04:00
1aba55a757 Merge branch 'user-cgdna' of github.com:ohenrich/lammps into correct-kokkos-docs 2020-04-10 23:46:16 -04:00