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3867972ae8
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make PYTHON_INSTDIR a cached variable and implement changes suggested by @junghans
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2019-03-26 22:08:53 -04:00 |
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07a6749ddc
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install LAMMPS python module with either install-python or install target if prerequisites are given
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2019-03-26 16:00:48 -04:00 |
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b0a07f189c
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must use top-level dir to get the correct modified status
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2019-03-25 21:18:17 -04:00 |
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2f20581b29
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Merge pull request #1374 from akohlmey/collected-small-fixes
Collected small changes for the next patch release
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2019-03-25 13:15:45 -04:00 |
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5d54e888d5
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Merge pull request #1371 from akohlmey/add-kim-query
Add kim_query command to KIM package
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2019-03-25 13:15:20 -04:00 |
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414f9b25d1
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cmake: move lmpgitversion generation to build phase
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2019-03-23 08:01:41 -06:00 |
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52f9e4a960
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allow overriding the location of the molfile plugin headers with CMake
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2019-03-22 14:11:02 -04:00 |
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e50c269a6b
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add install-python target with suitable error message also when not building a shared library
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2019-03-22 12:51:57 -04:00 |
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04f999fdd6
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add install-python target to CMake build system. decouple python module install from python package
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2019-03-22 12:35:21 -04:00 |
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fed48427be
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update lib/kim/Install.py to support md5 checksum. update CMake support as needed
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2019-03-19 15:48:03 -04:00 |
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4e632d1b79
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implement another suggestion from @junghans
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2019-03-06 17:32:08 -05:00 |
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2918dae87e
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correct variable name and path to find the local .git folder
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2019-03-06 17:12:41 -05:00 |
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fe56cf04bc
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simplify the detection of whether the source folder is checked out from a local git repo
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2019-03-06 17:04:14 -05:00 |
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c5a3b034ce
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implement various suggestions to improve the use of git information gathered
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2019-03-05 17:29:34 -05:00 |
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1e573bd557
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when compiling LAMMPS in a git checkout, embed and print git branch and revision info into the executable
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2019-03-05 08:35:53 -05:00 |
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326a97624e
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Merge pull request #1317 from ornladios/adios2-master
USER-ADIOS package with ADIOS 2.x
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2019-02-27 17:24:12 -05:00 |
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54e5c76333
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Bump KIM API version to 2.0.1
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2019-02-27 15:50:08 -06:00 |
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e6df92e65a
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Merge pull request #1011 from ellio167/kim-v2-update
KIM v2 update
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2019-02-21 20:06:59 -05:00 |
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75fe967876
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remove fluff about adios in CMakeLists.txt.
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2019-02-20 09:02:24 -05:00 |
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9c52a37546
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PIMPL implementation of USER-ADIOS to hide internal data from style header file
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2019-02-20 09:02:24 -05:00 |
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24234d3a0b
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Fixed cmake build for ADIOS 2.x
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2019-02-20 09:02:24 -05:00 |
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8db88b1c02
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Added initial untested ADIOS 2.x code with cmake building problems
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2019-02-20 09:02:24 -05:00 |
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f25b06fab0
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Fixes part of issue #1278
Moving a style header or touching it will now trigger a reconfiguration before
building, which triggers style files to be regenerated.
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2019-02-17 20:53:21 -05:00 |
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c2725f5a49
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forward build type setting to compiling downloaded KIM API
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2019-02-15 03:53:09 -05:00 |
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afa50ab61a
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update pathspec when linking KIM API from downloaded archive
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2019-02-15 02:21:07 -05:00 |
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e95cf4e917
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Some various doc updates for kim-api support
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2019-02-14 13:38:28 -06:00 |
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333154633b
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Merge branch 'master' into kim-v2-update
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2019-02-14 13:29:50 -06:00 |
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9ac908f05f
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switch download server for voro++ from LBL to download.lammps.org, which seems much more reliable
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2019-02-13 09:53:20 -05:00 |
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927dc262b2
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Update CMake & Install.py for KIM API v2
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2019-02-06 23:41:45 -06:00 |
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d677335b23
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Merge remote-tracking branch 'lammps/master' into kim-v2-update
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2019-02-03 12:45:44 -06:00 |
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f2a977884c
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Merge pull request #1290 from akohlmey/python-script-portability
Use argparse module in for Install.py scripts in lib and further portability and consistency enhancements. Some lint removal as well.
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2019-02-01 01:18:40 +01:00 |
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ef5c327f74
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Merge branch 'master' into collected-small-changes
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2019-01-31 11:45:15 +01:00 |
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53f600ea35
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use enable all available plumed modules when using download/compile mode
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2019-01-26 09:55:48 -05:00 |
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9caf0ce3e1
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add USER-YAFF package to build system
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2019-01-22 12:17:04 -05:00 |
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23ce00f366
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Merge remote-tracking branch 'lammps/master' into kim-v2-update
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2019-01-16 21:49:14 -06:00 |
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d01c28002f
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update plumed support to use newer version of the library
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2019-01-14 17:47:36 -05:00 |
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b20be581c1
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update Eigen3 download to version 3.3.7 for CMake as well
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2019-01-14 15:02:09 -05:00 |
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6fbd0c08cc
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if we want to check for C++ includes, we should now check for cmath not math.h
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2019-01-10 16:50:00 -05:00 |
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444dcca433
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Merge pull request #1254 from akohlmey/remove-reax-meam
Remove REAX and MEAM packages
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2018-12-29 13:06:07 -05:00 |
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dd028e9071
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Merge pull request #1266 from junghans/cmake_doc
doc: add CMAKE_VERBOSE_MAKEFILE and CXX_COMPILER_LAUNCHER
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2018-12-29 12:09:06 -05:00 |
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92e1cbe788
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cmake: find install location of FindLAMMPS.cmake
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2018-12-28 17:57:13 -07:00 |
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f8a5a78c2c
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doc: add CMAKE_VERBOSE_MAKEFILE and CXX_COMPILER_LAUNCHER
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2018-12-20 09:17:34 -07:00 |
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6c0b100a53
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Merge branch 'master' into kim-v2-update
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2018-12-16 15:56:33 -06:00 |
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540026ca00
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Update CMakeLists.txt to avoid merge conflicts
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2018-12-16 15:53:51 -06:00 |
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b068690e13
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Update for kim-api beta.3 release
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2018-12-12 16:21:54 -06:00 |
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d15e4b1546
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Merge branch 'master' into remove-reax-meam
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2018-12-11 23:31:48 -05:00 |
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8422bf64fa
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prevent configuring -D PKG_USER-ATC=yes with -D LAMMPS_SIZES=bigbig in CMake
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2018-12-10 17:42:38 -05:00 |
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3f49eb8515
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remove meam and reax from build system
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2018-12-10 12:14:03 -05:00 |
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a30e1b2670
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cmake: USER-PLUMED does not LAPACK anymore
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2018-12-07 06:10:29 -07:00 |
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ebacd5ca6b
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anti-nitpick hack
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2018-11-27 14:36:59 -05:00 |
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