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f592e3184e
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simplify Molecule::check_attributes()
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2022-08-13 16:56:53 -04:00 |
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78c10bac4a
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clang-format update
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2022-04-23 13:08:11 -04:00 |
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79a7d2abf6
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remove error docs from header files
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2022-04-22 23:31:15 -04:00 |
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b45a6d7720
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Apply override to AtomVec classes
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2022-01-19 17:31:41 -05:00 |
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bca99f684f
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update list and order of include files from include-what-you-use analysis
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2021-09-18 14:16:48 -04:00 |
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09c19a936b
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update URLs in source code and manual
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2021-05-24 14:18:20 -04:00 |
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7fcd449864
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apply clang-format to all headers with some exceptions
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2021-05-14 19:16:07 -04:00 |
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df7fe4431f
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make LAMMPS homepage URL and C++ indicator comments consistent
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2021-04-22 21:26:07 -04:00 |
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2db78823a0
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open() method not really needed.
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2021-03-03 08:43:23 -05:00 |
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371ee63c2c
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begin refactor of parsing of sections
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2021-03-02 11:06:24 -05:00 |
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b6d98707ec
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molecule: revert overzealous error checking
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2020-09-23 11:23:10 -04:00 |
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2b30661b07
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molecule: correctly update docs
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2020-09-23 10:46:23 -04:00 |
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390c6ba106
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rechecking some corefiles with IWYU after the many updates
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2020-09-03 15:28:07 -04:00 |
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c2b557233e
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Update value parsing in Molecule
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2020-06-09 12:12:52 -04:00 |
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71582c99ca
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rearrange pointer variables to a more logical location, quell compiler warning and initialize all pointer
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2020-03-18 22:51:16 -04:00 |
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43a6c13f01
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change 'groups' to 'fragments'
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2020-03-10 21:11:34 -06:00 |
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21ae5ac533
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groups in molecule templates: docs
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2020-03-07 20:03:33 -07:00 |
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337cee7b49
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add groups to molecule templates
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2020-03-06 22:51:42 -07:00 |
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e71d298f65
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molecule template molecule IDs: error docs
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2020-03-06 20:40:34 -07:00 |
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90bfa6b783
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add molecule IDs to molecule templates
for when more than one molecule per file
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2020-03-02 00:53:19 -07:00 |
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5221ac2d55
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add placeholders to include files for error messges
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2018-04-03 17:48:31 -06:00 |
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7d2ada9d80
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whitespace cleanup
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2018-03-15 21:57:45 -04:00 |
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3a054d1a82
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Fix more typos in src files
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2017-03-07 00:55:01 -05:00 |
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5881c6da6f
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15304 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2016-07-13 22:55:25 +00:00 |
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6367c3700b
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15302 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2016-07-13 22:36:46 +00:00 |
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70aa37e4c8
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14589 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2016-02-15 15:26:57 +00:00 |
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9e20448834
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14582 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2016-02-08 16:18:20 +00:00 |
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f5946c73f7
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14418 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2016-01-11 22:00:04 +00:00 |
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354e20f431
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14220 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-10-30 20:04:06 +00:00 |
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b229c719d0
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14163 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-10-22 21:48:05 +00:00 |
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5a21de608e
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13609 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-07-16 21:21:40 +00:00 |
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bd37304ade
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13332 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-03-30 23:17:06 +00:00 |
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84a5ec39ec
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13278 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-03-23 23:30:50 +00:00 |
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4c2103f695
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13253 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-03-18 21:54:52 +00:00 |
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7518fae9bc
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12641 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-10-21 17:09:24 +00:00 |
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df0c8d061f
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11615 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-03-10 15:42:05 +00:00 |
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8a50725149
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11388 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-01-30 17:06:17 +00:00 |
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7f81b2f2ff
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11371 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-01-29 01:37:09 +00:00 |
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9b1cc599f6
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11341 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-01-27 16:59:18 +00:00 |
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0ce16af78b
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11328 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-01-25 22:46:08 +00:00 |
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41c5be7a8e
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11300 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-01-22 18:33:55 +00:00 |
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bad19033d0
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11250 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-01-17 18:43:09 +00:00 |
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7292ac7402
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11154 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-01-07 20:53:12 +00:00 |
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4f40cb9dec
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11149 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-01-07 16:22:29 +00:00 |
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bbc2a764c3
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11141 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-01-07 00:13:44 +00:00 |
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a9f063d9d9
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11114 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-12-17 00:21:39 +00:00 |
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