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543ceaaf89
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when using "write_data" with "noinit" and "pair ij" generate missing pair coeffs by calling Pair::init_one()
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2024-08-06 06:17:44 -04:00 |
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db72d4b73a
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add general tri options to read and write data commands and Domain class
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2023-08-31 14:34:37 -06:00 |
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2132b1d904
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update developer reference text
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2022-10-24 11:08:26 -04:00 |
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cccf3f6f78
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change email for contacting LAMMPS developers, add to homepage checker
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2022-10-20 20:36:03 -04:00 |
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f9717049b1
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Merge branch 'develop' into type-labels
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2022-08-08 17:16:50 -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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e13a70ad2f
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Merge branch 'develop' into type-labels
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2022-03-23 01:08:35 -04:00 |
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c9776dad6f
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Apply override to Command classes
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2022-01-20 16:35:59 -05:00 |
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8d4956046b
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Merge branch 'develop' of https://github.com/lammps/lammps into lammps-develop
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2021-11-04 21:20:29 -04:00 |
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d0416757b7
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simplify using new APIs
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2021-10-24 18:00:15 -04:00 |
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b124de3484
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Merge branch 'master' of https://github.com/lammps/lammps into lammps-master
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2021-06-07 22:48:51 -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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a1665fddc8
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next iteration of preparing for clang-format
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2021-04-30 13:51:14 -04:00 |
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980244dd0c
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add protection comments
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2021-04-27 22:31:01 -04:00 |
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0beac58e21
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some file permissions
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2021-04-27 15:38:39 -04:00 |
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1e294111e7
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Merge branch 'master' of https://github.com/lammps/lammps into lammps-master
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2021-04-27 14:46:33 -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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75579fc100
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take advantage of having the common Command base class to unify code paths
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2021-04-14 07:05:00 -04:00 |
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b53822da46
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provide Command base class in command.h for deriving command styles from
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2021-04-13 17:47:00 -04:00 |
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4f219a94aa
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nolabel for write_data
also bug fixes
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2021-01-31 16:37:09 -05:00 |
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739dc46fab
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type labels: restart support
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2021-01-19 21:52:22 -05:00 |
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9925122cea
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more IWYU updates
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2020-09-03 00:22:09 -04:00 |
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7918919d30
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enable write_data for atom styles with bonus data
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2020-07-06 17:30:45 -06:00 |
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04d7eacc2f
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remove .c_str() in several places because it is no longer neede
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2020-06-05 16:40:48 -04:00 |
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439eee3b86
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get rid of BIGINT_FORMAT and use std::string.replace() to expand time step in data and restart file names
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2020-06-04 21:38:00 -04:00 |
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4ec3a508fc
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bulk removal of #include <cstdio> from header files
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2019-06-27 21:54:07 -04:00 |
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e4071d7f46
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replace C-style include files with their C++ equivalents
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2018-04-27 18:00:24 -04:00 |
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49aad1d157
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rename noextra flag to nofix
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2018-03-04 09:56:22 -05:00 |
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a323147819
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noextra option for write_data
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2018-03-03 14:28:35 -07:00 |
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d2da49cdf9
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modifications to correctly print modified dihedrals, impropers
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2018-01-22 23:56:11 -07:00 |
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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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f7bc08d83d
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13601 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-07-15 21:29:44 +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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677b11428e
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11387 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-01-30 16:09:37 +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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c2fd1c17b2
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10611 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-08-20 20:44:10 +00:00 |
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d694b0dee0
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10196 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-06-29 21:20:42 +00:00 |
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8492c4149e
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9787 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-04-23 20:35:26 +00:00 |
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8ddd160c3c
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9748 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-04-03 19:58:40 +00:00 |
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609226f8d0
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9743 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-04-03 17:59:23 +00:00 |
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cbc01e5758
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9740 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-04-03 16:57:24 +00:00 |
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