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dd03c7232a
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Merge remote-tracking branch 'github/master' into move-convenience-functions
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2020-08-31 11:41:18 -04:00 |
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a4d3b21a43
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Merge pull request #2322 from Vsevak/cmake_cuda
Fix CMake building for CUDA 11
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2020-08-31 11:33:52 -04:00 |
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cf11945e21
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get rid of utils::boundsbig() by making it a template function with two specializations
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2020-08-31 11:25:43 -04:00 |
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8034a83ee8
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Merge pull request #2325 from akohlmey/fortran-interface
New Fortran interface to LAMMPS
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2020-08-31 10:27:10 -04:00 |
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3c71d300e5
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Merge pull request #2320 from akohlmey/programmer-guide
Add programmer guide part 2
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2020-08-31 10:06:04 -04:00 |
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c7360fb808
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include example use of PotentialFileReader class
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2020-08-31 07:45:52 -04:00 |
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c84033677c
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add documentation for potential file reader
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2020-08-31 07:31:28 -04:00 |
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33f2cbc713
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add docs for TextFileReader class to developer guide
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2020-08-31 06:57:16 -04:00 |
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39a9974f3d
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add ValueTokenizer example and use captions with code-blocks
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2020-08-30 23:57:02 -04:00 |
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569b6f95a3
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no need to use ValueTokenizer. Make code more compact.
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2020-08-30 23:32:17 -04:00 |
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4484699ab6
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fix spelling
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2020-08-30 15:52:42 -04:00 |
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65d2ee7464
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add work-in-progress marker to fortran library wrapper
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2020-08-30 15:23:02 -04:00 |
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199cfeba78
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more tweaks. doxygen translation has no more warnings now.
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2020-08-30 14:32:53 -04:00 |
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cd0cdf0b74
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silence compiler warning
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2020-08-30 14:28:29 -04:00 |
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f3ed1dea4d
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minor tweaks
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2020-08-30 14:28:19 -04:00 |
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8d45b724a6
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fix bug in conventional build makefile preventing the correct Install.py in the lib folder to be run
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2020-08-30 14:12:53 -04:00 |
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4b0999e167
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complete documentation of tokenizer classes
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2020-08-30 14:12:21 -04:00 |
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5623009962
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arch 3.0 is dropped in CUDA 11
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2020-08-30 13:12:42 +03:00 |
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96ee132e85
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start documenting tokenizer classes
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2020-08-30 01:50:37 -04:00 |
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8d2c16ad66
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remove trailing whitespace
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2020-08-30 00:31:04 -04:00 |
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f123246189
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minor doc updates
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2020-08-30 00:25:01 -04:00 |
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ceeaf1e988
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update and correct documentation for utils functions
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2020-08-29 23:51:46 -04:00 |
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9c404e02fd
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update include file conventions
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2020-08-29 22:56:37 -04:00 |
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83a9e5e724
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handle spelling issues with new doc text
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2020-08-29 22:55:05 -04:00 |
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e51a5ad8f4
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import doxygen docs for new utils functions
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2020-08-29 22:46:25 -04:00 |
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4396dbd9a3
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move Force::open_potential() to utils::open_potential()
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2020-08-29 22:37:14 -04:00 |
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798226967f
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Merge branch 'move-convenience-functions' of github.com:akohlmey/lammps into move-convenience-functions
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2020-08-29 22:22:45 -04:00 |
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6b7f4c500f
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document changes to LAMMPS_POTENTIALS environment variable
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2020-08-29 22:22:27 -04:00 |
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5a22f4d7f2
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support that LAMMPS_POTENTIALS is a real path variable with multiple entries, not just a single folder
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2020-08-29 22:22:03 -04:00 |
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b06ba74d18
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support that LAMMPS_POTENTIALS is a real path variable with multiple entries, not just a single folder
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2020-08-29 22:09:07 -04:00 |
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05ff352021
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add utils::open_potential() function to utils namespace
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2020-08-29 22:08:16 -04:00 |
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7413dc783e
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add tokenizer tests for splitting path environment variables
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2020-08-29 22:07:22 -04:00 |
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8601e608ca
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add unit tests for utils::bounds() and utils::boundsbig()
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2020-08-29 22:00:07 -04:00 |
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96d8d12a88
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replace calls to force->*numeric() with the corresponding utils::*numeric()
this also removes the now obsolete functions from Force
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2020-08-29 20:31:02 -04:00 |
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27b4e93bf5
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silence compiler warnings
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2020-08-29 18:32:21 -04:00 |
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741a1d1fc9
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move Input::expand_args() to utils::expand_args()
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2020-08-29 18:32:10 -04:00 |
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fcd0b9f78f
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move Force::bounds() and Force::boundsbig() to utils.
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2020-08-29 18:23:03 -04:00 |
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60dfb6f77f
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still need to disable variable tracking to silence unwanted warnings on ubuntu
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2020-08-28 22:03:27 -04:00 |
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31c91a8928
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fix typo
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2020-08-28 21:22:06 -04:00 |
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cec18b6aef
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add docs for the new fortran interface
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2020-08-28 20:57:19 -04:00 |
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e44707d5e1
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add unittest support for the fortran interface to LAMMPS
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2020-08-28 20:56:52 -04:00 |
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3e92647abb
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add new "official" fortran interface to LAMMPS in new folder "fortran"
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2020-08-28 20:56:15 -04:00 |
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2e1b4498bd
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update false positives
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2020-08-28 20:30:00 -04:00 |
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7b6924329f
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make doxygen docs and code consistent
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2020-08-28 20:25:38 -04:00 |
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cb1a2601e1
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add more existing programmer guide docs
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2020-08-28 20:25:09 -04:00 |
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3be064748d
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Merge pull request #2318 from akohlmey/programmer-guide
Programmer guide part 1
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2020-08-28 20:14:32 -04:00 |
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02ea7af1f7
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let dummy tests pass
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2020-08-28 18:49:39 -04:00 |
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52f7f3629d
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Merge branch 'master' into programmer-guide
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2020-08-28 18:49:15 -04:00 |
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876c53a275
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Merge pull request #2310 from lammps/library-refactor
LAMMPS C library interface and python module refactor
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2020-08-28 18:40:16 -04:00 |
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2a365c17e0
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update utils namespace documentation including doxygen parts
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2020-08-28 18:21:18 -04:00 |
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