6767fa5604
update supported plumed library to version 2.5.3
2019-10-20 16:27:32 -04:00
f4fcd2a911
flag that MESSAGE package is not compatible with -DLAMMPS_BIGBIG
2019-10-19 09:50:07 -04:00
108b9a0a36
USER-MOLFILE cannot be configured with CMake 2.8.12, requiring 3.10.
2019-10-17 06:33:13 -04:00
9a4f208e4e
need to enable C compilation to detect BLAS/LAPACK on CMake 2.8.12
2019-10-17 06:32:35 -04:00
68adc56e93
Merge branch 'master' into fix-compiler-warnings
2019-10-17 06:03:59 -04:00
e4c77f047f
document COLVARS_LEPTON flag to CMake configuration
2019-10-16 16:19:12 -04:00
437c0e59f2
Merge pull request #1724 from lammps/lepton-cxx11-handling
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Upgrade Lepton library, handle its C++11 requirement
2019-10-16 21:11:00 +02:00
2c9ae7ab4b
Add -DCOLVARS_LEPTON, track user's choice via DISABLE_CXX11_REQUIREMENT
2019-10-16 08:35:37 -04:00
4aa47386ea
make handling of (temporary) C++11 check disabling define behave consistent across CMake versions
2019-10-15 18:42:59 -04:00
9a3824bfc1
add SNAP to "most" preset, since it seems to be used more frequently these days
2019-10-15 16:55:10 +02:00
b6a6638f49
Add CMake recipe for USER-COLVARS, test C++11 before including Lepton
2019-10-14 16:05:45 -04:00
28c9255f99
don't include USER-PLUMED in "most" preset
2019-10-14 08:02:59 -04:00
178ca78dd9
add TODO comment for experimental and thus currently undocumented CMake option
2019-10-07 18:57:28 +02:00
3f0d1cb270
cmake: LMP_KOKKOS define is always needed
2019-09-24 13:15:48 -06:00
d7a8792916
cmake: allow to build against an external libkokkos
2019-09-19 14:26:07 -06:00
2ea11b3195
implement test for C++11 and document it
2019-09-18 15:50:26 -04:00
d62ef0df82
add omitted cmake entries for recent KOKKOS package changes
2019-09-13 12:26:07 -04:00
92c77a2b37
Merge pull request #1634 from junghans/kim-api-version
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cmake: add version check for kim-api
2019-09-05 13:59:46 -04:00
364ccf6361
Fix typo
2019-09-04 16:26:03 -04:00
09937c9941
Add missing npair style for KOKKOS when using CMake
2019-08-22 18:36:36 -04:00
5cee51204c
Adjust warnings for default kim download behavior settings
2019-08-17 12:04:00 -05:00
3a4e6c0dfd
Revert "Update FindKIM-API.cmake"
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This reverts commit 2f531d0dab
2019-08-17 11:40:13 -05:00
2f531d0dab
Update FindKIM-API.cmake
2019-08-16 12:05:20 -06:00
379fa22147
FindKIM-API.cmake: address Ryan's comments
2019-08-16 10:30:09 -06:00
42711245a2
bump kim-api to 2.1.3
2019-08-16 10:08:23 -06:00
cd77f71e99
cmake: add version check for kim-api
2019-08-15 12:56:15 -06:00
edbd525bcb
cmake: install chain.x as well
2019-08-14 17:16:43 -06:00
3ef93d6e1b
cannot forced enable FFMpeg and gzip on windows yet.
2019-08-05 16:59:18 -04:00
16bf916dd0
Merge pull request #1616 from akohlmey/fixes-for-stable
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Collected small fixes for stable release
2019-08-05 16:48:50 -04:00
f2757eaf41
Mention LAMMPS_LIB_SUFFIX in docs
2019-08-05 14:00:56 -04:00
096c225594
Merge pull request #1613 from rbberger/cmake_docs_update
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Update CMake documentation
2019-08-04 18:32:11 -04:00
58d27403f1
CMake tweaks to improve building LAMMPS for windows with mingw on Linux
2019-08-04 18:28:26 -04:00
5b3423c60e
tweaks for Linux to Windows cross-compilation
2019-08-03 11:16:14 -04:00
eb7fa1b6cb
Update CMake documentation
2019-08-02 17:04:59 -04:00
5b4b418289
use check_language() instead of enable_language() to get fortran compiler name
2019-08-01 18:24:14 -04:00
8df7f51470
Merge branch 'master' into timeout-for-replica
2019-08-01 16:56:49 -04:00
f9e34825f0
workaround for xcode oddity with compiling voro++
2019-08-01 16:42:52 -04:00
bc79412203
list(TRANSFORM ...) is not portable to older versions of cmake. work around it.
2019-07-30 22:54:02 -04:00
528ec75f88
special case for MacOSX not needed
2019-07-30 16:38:40 -04:00
f5bf86b32d
more improvements to CMake build for USER-PLUMED on MacOSX
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default to shared linkage on MacOSX to avoid linker issues from
configure/cmake library detection differences
link/depend on GSL and LAPACK explicitly only for static linkage
2019-07-30 16:27:00 -04:00
2d93a713e2
Merge branch 'master' into collected-small-changes
2019-07-30 14:14:11 -04:00
7ab7691c51
update PLUMED support to version 2.5.2
2019-07-30 05:57:57 -04:00
c9f3f99ee8
Update to kim-api-2.1.2
2019-07-29 21:48:12 -05:00
6833d6def6
Merge branch 'master' into kim-simulator-models
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# Resolved Conflicts:
# src/KIM/kim_query.cpp
# src/KIM/pair_kim.cpp
2019-07-29 20:43:10 -04:00
96e0b03ede
.frc files only need to be installed if msi2lmp is built
2019-07-29 13:38:38 -04:00
5307558727
need to install some base C++ headers for C++ library use
2019-07-29 13:34:04 -04:00
010cb0edf3
Add warning to cmake if PKG_KIM=ON but DOWNLOAD_KIM not set & KIM is not found
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This can be a scenario where the user has KIM installed but does not have the
environment setup correctly to be found. The config. step should provide some
warning of this. Otherwise, it is easy to miss the fact that KIM is being
downloaded and built.
2019-07-26 11:10:54 -05:00
0bb9df76c2
correct shell profile variables to point to the installation directory
2019-07-26 09:58:18 -04:00
e8d891c0dd
simplify installation of data folders and make it consistent
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fixes #1586
2019-07-26 06:06:03 -04:00
ca291f1015
Update to kim-api-2.1.1
2019-07-25 11:47:56 -05:00
