ad855ad7ea
remove unused constants
2024-02-05 20:26:23 -05:00
6442e05988
even more define to static constexpr conversions
2024-01-25 02:17:28 -05:00
12422ff510
replace defines with static constexpr declarations
2024-01-21 15:53:35 -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
d599a541b5
improved some error messages in velocity.cpp and dump.cpp
2022-08-13 19:10:57 +08:00
5b40e4cb38
new accessor APIs for fixes and computes in Modify plus a few applications
2021-10-16 06:00:28 -04:00
6adac6b637
Merge branch 'master' into parse-logical-keyword
2021-09-20 20:41:48 -04:00
f80259dfae
some applications of the new function
2021-09-19 19:05:40 -04:00
bca99f684f
update list and order of include files from include-what-you-use analysis
2021-09-18 14:16:48 -04:00
a7d05cff09
streamline code by using changes in Modify class
2021-08-06 13:39:02 -04:00
b16bca2f45
simplify
2021-08-06 13:39:02 -04:00
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
8a49bf3a31
fix missing argument bug in velocity code and simplify a second case
2021-04-23 18:47:02 -04:00
15ce976dba
simplify
2021-04-23 16:32:27 -04:00
b53822da46
provide Command base class in command.h for deriving command styles from
2021-04-13 17:47:00 -04:00
1e7e930d55
generalize match to fit all rigid/small derived fixes
2021-04-04 21:14:40 -04:00
24bf1e5b0c
make use of utils::strdup()
2021-02-04 17:33:02 -05:00
4e791ac4f7
replace 'strstr(xxx,"x_") == xxx' with utils::strmatch("^x_")
2021-02-04 15:20:43 -05:00
adf74b3a22
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
0f6a34775c
Merge branch 'master' into symbolic-atom-constants
2020-09-15 17:44:31 -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
9d0c3bc665
replace some numeric constants in Atom and AtomVec classes with enumerators
2020-09-11 19:07:55 -04:00
9925122cea
more IWYU updates
2020-09-03 00:22:09 -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
d8cd12b285
print warning only on MPI rank 0
2020-08-09 13:57:04 -04:00
2c0eeeb976
one more chunk of files in src folder to be cleaned up
2019-07-05 14:43:20 -04:00
256531a29a
put implementation header first for all remaining main folder source files
2019-07-03 19:34:13 -04:00
61e9dc4c8d
more accurate checking for styles using utils::strmatch() instead of strcmp() or strncmp()
2019-06-07 07:14:57 -04:00
dbbf198edb
more accurate matching of styles using utils::strmatch()
2019-04-04 17:10:27 -04:00
1fc3b4618c
remove dead code and silence compiler warnings
2018-11-15 16:50:56 -05:00
e9bc939098
Fix more unused parameter warnings ( #1076 )
2018-08-23 12:22:44 -06:00
e4071d7f46
replace C-style include files with their C++ equivalents
2018-04-27 18:00:24 -04:00
968de8548c
apply test for overlap with rigid bodies to set and velocity command
2017-06-05 13:06:53 -04:00
f9a9e27f5a
add error location propagation to atom->set_mass() and atom->check_mass()
2016-10-26 16:01:40 -04:00
7bf1d9b40f
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15489 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-08-23 22:17:44 +00:00
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
9a878cdd67
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14128 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-10-21 18:29:37 +00:00
3841dd58ca
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13931 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-08-21 22:55:12 +00:00
83f439bcd8
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13196 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-06 15:35:35 +00:00
e7e19bf0cb
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13195 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-05 15:57:12 +00:00
ee00c0f654
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13169 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-04 15:24:51 +00:00
f1eb006c26
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13116 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-02-16 16:54:21 +00:00
06b956da10
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13077 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-02-06 21:59:28 +00:00
e57c7828a9
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13075 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-02-06 20:39:07 +00:00
48e1a950b9
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12718 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-11-18 20:01:25 +00:00
b0a5f4a280
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12717 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-11-18 15:41:05 +00:00
f14e5cdce6
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12714 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-11-18 00:15:46 +00:00
c8fce1f525
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11874 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-05-01 21:10:56 +00:00
