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77f803b366
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Update pair_charmm.rst
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2020-09-02 09:14:20 -04:00 |
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a9cf25db4c
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Update pair_eam.rst
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2020-09-02 09:13:59 -04:00 |
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7e733913d7
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Update pair_fep_soft.rst
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2020-09-02 09:03:00 -04:00 |
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45100528ad
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Update pair_coul.rst
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2020-09-02 08:54:53 -04:00 |
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80519cd109
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Merge pull request #2331 from rbberger/zstd_support
Update COMPRESS package
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2020-09-01 15:01:04 -04:00 |
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31bd76efa5
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Merge remote-tracking branch 'origin/master' into zstd_support
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2020-09-01 12:58:41 -04:00 |
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9d3e3526a0
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Add false positives and fix spelling in docs
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2020-09-01 12:30:35 -04:00 |
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a2b5c379f2
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Update docs for COMPRESS styles
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2020-09-01 12:17:08 -04:00 |
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c6de769696
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Merge branch 'master' of github.com:tomswinburne/lammps
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2020-09-01 11:12:29 +02:00 |
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ac080228dc
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whitespace style fix
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2020-09-01 11:12:05 +02:00 |
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0541996919
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Merge branch 'master' into master
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2020-09-01 10:59:03 +02:00 |
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675cf20e93
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Merge remote-tracking branch 'github/master' into move-convenience-functions
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2020-08-31 12:58:21 -04:00 |
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9a4ec23c7f
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Merge pull request #2327 from akohlmey/remove-doxygen-tool
Remove doxygen tool folder and references to it in the manual
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2020-08-31 12:49:24 -04:00 |
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1ff34d4b13
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avoid doxygen lookup ambiguity
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2020-08-31 12:46:05 -04:00 |
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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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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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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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e8e57b0628
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remove doxygen tool folder and references to it in the input as it is no longer compatible and needed
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2020-08-30 19:59:52 -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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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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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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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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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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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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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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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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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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e64a977ae9
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include documentation of utility functions in utils:: to developer guide
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2020-08-28 17:14:49 -04:00 |
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a1bf772df2
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move modifying and extending LAMMPS section to programmer guide
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2020-08-28 17:14:29 -04:00 |
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8fcd72405a
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port over more of the framework of the programmer guide and remove programming details from user guide
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2020-08-28 16:32:23 -04:00 |
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ded657120d
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Merge pull request #2312 from akohlmey/developer-guide
Integrate text from developer.tex file to the manual
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2020-08-28 15:01:27 -04:00 |
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899144c0f8
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Merge pull request #2314 from jrgissing/bond/react-RMSD_constraint
Bond/react: add RMSD constraint
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2020-08-28 12:29:11 -04:00 |
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9f2eba981a
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a few more tweaks and spellcheck to make this ready for merging
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2020-08-28 11:44:31 -04:00 |
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ef50a67169
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bond/react: make rmsd constraint lowercase
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2020-08-28 11:06:27 -04:00 |
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f8495975d3
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transfer the rest of the Developer guide and remove the .tex versions and references to it
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2020-08-28 10:52:45 -04:00 |
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f0788bfe86
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transfer of developer.tex almost complete
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2020-08-28 09:54:01 -04:00 |
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b16746e46e
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Merge pull request #2313 from ndtrung81/gpu-bugfix
Fixed bugs in the CPU kernel for beck, beck/omp and the GPU kernel of gauss/gpu
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2020-08-27 19:56:50 -04:00 |
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463774319e
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add missing parenthesis
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2020-08-27 17:57:44 -04:00 |
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b1fae04751
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use consistent style when referencing packages
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2020-08-27 17:44:49 -04:00 |
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7b4891a9a3
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document the behavior of the gauss pair style to ignore special bond factors
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2020-08-27 17:41:43 -04:00 |
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de4bf77757
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two typos on pair peri doc page
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2020-08-27 13:32:27 -06:00 |
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32aede7769
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minor doc clarification
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2020-08-27 14:53:09 -04:00 |
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583a09c808
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Merge branch 'master' of https://github.com/lammps/lammps into lammps-master
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2020-08-27 12:02:08 -04:00 |
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f314b7e54f
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update format from enumerate to itemize and start next subsection
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2020-08-26 23:05:59 -04:00 |
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