27da716852
getting out of the insurance business :-)
2023-01-23 16:45:41 -05:00
2132b1d904
update developer reference text
2022-10-24 11:08:26 -04:00
cccf3f6f78
change email for contacting LAMMPS developers, add to homepage checker
2022-10-20 20:36:03 -04:00
67f6adebb7
whitespace fixup with dynamic casts
2022-09-10 13:26:38 -04:00
ef4e41d2a2
programming style and format updates
2022-04-12 22:52:07 -04:00
9d907e31b3
recover compilation
2022-04-11 12:40:59 -04:00
36723853c9
Merge branch 'develop' into BPM
2022-04-11 12:18:34 -04:00
200b4f13c7
use dynamic cast instead of c-style cast when casting from base type to derived class
2022-04-10 18:18:06 -04:00
b97c30e6e7
more refactoring, modernizing, removing of debug code
2022-03-31 06:24:44 -04:00
92a968a8a9
Resolving merge conflicts
2022-03-23 14:28:27 -06:00
de4a9f268e
rename reverse communication calls
2022-02-21 21:18:28 -05:00
4c0192cae1
rename forward communication functions for pair, fix, compute, and dump
2022-02-21 21:15:10 -05:00
744e615dbb
Revamping public methods for history, adding support for bond react
2021-12-13 17:35:53 -07:00
f3eac179e6
Expanding broken bonds documentation, adding support for more create/delete bond commands, misc small edits
2021-12-06 17:27:25 -07:00
09c19a936b
update URLs in source code and manual
2021-05-24 14:18:20 -04:00
d1941392d3
disable clang-format for all existing .cpp files (for now)
2021-05-05 23:53:38 -04:00
183b30abd7
use strmatch() consistently to detect respa and verlet runstyles with optional suffix
2021-03-30 18:30:22 -04:00
8c4918457f
consistently compare atom->molecular against enumerator constants
2021-03-14 01:25:22 -05:00
e2e6639013
add typecast to avoid (unlikely but possible) integer overflows.
...
this will silence a lot of static code analysis warnings
2021-02-02 17:27:04 -05:00
adf74b3a22
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
f1ef7d85a8
T2345: Replace instances of NULL with nullptr
...
The following changes have been applied to src and lib folders:
regex replace: ([^"_])NULL ⇒ \1nullptr (8968 chgs in src, 1153 in lib)
Manually find/change: (void \*) nullptr ⇒ nullptr (1 case)
regex find: ".*?nullptr.*?"
Manually ~14 cases back to "NULL" in src, ~2 in lib
regex finds a few false positive where nullptr appears between two
strings in a function call
2020-09-12 09:34:38 -06:00
6113169a47
IWYU based include statement cleanup
2020-09-02 17:39:34 -04:00
96d8d12a88
replace calls to force->*numeric() with the corresponding utils::*numeric()
...
this also removes the now obsolete functions from Force
2020-08-29 20:31:02 -04:00
a957d1c4c2
fix whitespace issue
2020-01-11 21:05:08 -05:00
8fa0700df1
add warning to fix bond/create
2020-01-10 16:49:09 -07:00
e5af9db84c
clean up includes in MC and MISC package
2019-07-07 11:49:13 -04:00
416911aa7e
more rearranging of include file order to put implementation headers first
2019-07-03 21:57:39 -04:00
da77dde04d
MC/fix_bond_break: Use TAGINT_FORMAT where appropriate
2019-04-04 14:51:40 +03:00
71bc72ec13
formatting: add additional space to avoid bad syntax highlights
2018-08-27 22:13:43 -04:00
92a4dc25b1
Fix unused params in packages ( #1076 )
2018-08-24 10:42:08 -06:00
e4071d7f46
replace C-style include files with their C++ equivalents
2018-04-27 18:00:24 -04:00
ee862d8bf5
replace leading tabs
2018-03-16 12:34:33 -04:00
30dede867a
Initialize pointers in MANYBODY and MC
2016-11-07 17:02:32 +01:00
9b2d5ff3e7
remove executable permissions on non-executables and non-scripts
2016-09-08 14:45:07 -04:00
48ba812f0a
Fixed initialization of arrays in computes/fixes in MC package
2016-08-28 22:23:22 -04:00
354e20f431
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14220 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-10-30 20:04:06 +00:00
bc1cf9965e
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14155 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-10-21 21:20:23 +00:00
1b31895cee
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12861 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-01-05 15:48:45 +00:00
c1e12f9508
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12285 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-08-08 17:55:44 +00:00
2cca373515
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12253 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-08-06 16:07:54 +00:00
3b1a73c3bd
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12151 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-06-27 17:39:48 +00:00
63bf83c6df
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11807 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-04-17 16:45:19 +00:00
b46ec2206e
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11802 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-04-16 23:21:07 +00:00
42bb280cf9
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11799 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-04-15 23:59:02 +00:00
2d77df2ec2
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11798 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-04-15 23:55:22 +00:00
bcd91423db
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11797 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-04-15 23:29:20 +00:00
9807630aa9
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11795 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-04-15 21:25:13 +00:00
1fac1d41fa
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11789 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-04-15 15:24:27 +00:00
631aa15a32
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11781 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-04-11 23:35:35 +00:00
63c9df46a9
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11514 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-02-07 23:41:55 +00:00
