Commit Graph

36 Commits

Author SHA1 Message Date
bfaa1e9ed0 whitespace 2022-04-08 16:28:57 -04:00
207b34ae12 allow for pre-timestepping comm with engine, e.g. for force eval 2022-04-06 16:38:58 -06:00
4bd28cf920 altering how plugin mode works 2022-04-06 15:24:02 -06:00
4fadf4c830 more debugging on plugin mode 2022-04-04 10:30:12 -06:00
19a6eecfbb more debugging for plugin engine mode 2022-03-31 14:41:38 -06:00
229f0af537 enable LAMMPS as driver to use plugin engine 2022-03-31 12:09:05 -06:00
65a083c83d add support for </>VELOCITIES command at nodes 2022-03-30 15:52:55 -06:00
faacf575b5 add support for >+FORCES command 2022-03-29 14:20:44 -06:00
82d0a55862 remove merge conflict message 2022-03-28 15:26:20 -06:00
4d037376af include GHub whitespace changes 2022-03-25 15:19:13 -06:00
055fefc542 finished MDI engine and test script debugging 2022-03-25 15:07:38 -06:00
6e959b6f43 more robust response to >COORDS command 2022-03-23 17:21:00 -06:00
66f97ef6bc whitespace 2022-03-23 17:22:46 -04:00
42dd772455 more work on plugin mode 2022-03-23 13:45:20 -06:00
c4425a1b0e debugging plugin mode 2022-03-23 11:17:51 -06:00
194751e800 add support for full minimizations 2022-03-22 09:32:31 -06:00
6555c7302d debugging for series of calcs 2022-03-22 08:38:39 -06:00
e12e06198c enable long md and min runs 2022-03-17 17:58:26 -06:00
cf06f71514 more refactoring of MDI engine 2022-03-16 17:46:01 -06:00
8d341e0714 remove EVAL command 2022-03-15 17:13:15 -06:00
99fa769800 more syncing 2022-03-15 16:15:57 -06:00
2a171cf2a2 sync new and old versions with current LAMMPS 2022-03-15 16:10:54 -06:00
636f00276e sync with current Modify methods for fix lookup 2022-03-15 14:12:23 -06:00
1a04eabb5e merge in current develop 2022-03-11 10:01:25 -07:00
8ba4e7e897 tweaks to src files, added examples dir 2022-03-11 09:33:34 -07:00
c8512249b7 Merge branch 'develop' into modify-fix-compute-accessors
# Conflicts:
#	src/PLUGIN/plugin.cpp
2021-10-27 21:14:05 -04:00
85433e8bd1 use true/false instead of 1/0 detected and changed by clang-tidy 2021-10-20 12:41:02 -04:00
dd2ff737f1 port mdi/engine command to new fix accessor API 2021-10-18 06:50:28 -04:00
faf9c1532a issue with EVAL command 2021-09-24 16:26:57 -06:00
be17d775e0 more debugging 2021-09-23 15:12:07 -06:00
c855c6f0ab rename 2 version to regular version 2021-09-23 12:55:28 -06:00
8b69b232a8 rename old version to old in filename 2021-09-23 12:48:43 -06:00
bca99f684f update list and order of include files from include-what-you-use analysis 2021-09-18 14:16:48 -04:00
385220fd4b format changes 2021-09-17 22:50:15 -04:00
9a19a814e4 apply clang-format to packages 2021-08-23 21:06:33 -04:00
878795e64a bulk rename of remaining USER- packages 2021-06-29 20:12:59 -04:00