|
|
cde3328927
|
update todo list
|
2023-07-26 08:42:08 -04:00 |
|
|
|
c96e4d59da
|
print more config info in about dialog
|
2023-07-26 02:33:50 -04:00 |
|
|
|
89b92e8b13
|
make "warning" boxes on errors "critical"
|
2023-07-26 02:33:32 -04:00 |
|
|
|
e6dc5822c3
|
more flexible font search
|
2023-07-26 02:33:06 -04:00 |
|
|
|
984a311dce
|
make compatible with windows cross-compiler
|
2023-07-26 01:29:30 -04:00 |
|
|
|
e548c0bde6
|
add todo list
|
2023-07-25 23:39:29 -04:00 |
|
|
|
e4dde8ebd4
|
fix shortcut implementation for log windows
|
2023-07-25 23:15:19 -04:00 |
|
|
|
368be8ac39
|
update list of keywords for VIM syntax highlighting
|
2023-07-25 21:40:54 -04:00 |
|
|
|
6e0aaab973
|
first stab at LAMMPS input file syntax highlighting
|
2023-07-25 21:35:38 -04:00 |
|
|
|
8b9174821a
|
capture stdout and display in dialog window
|
2023-07-25 16:01:02 -04:00 |
|
|
|
5d34cc624d
|
temporarily disable highlighting a line
|
2023-07-25 13:06:52 -04:00 |
|
|
|
ab792acbe5
|
catch errors via library interface and present dialog displaying them
|
2023-07-25 13:06:27 -04:00 |
|
|
|
7eb2afa994
|
integrate syntax highlight code from example (uses c++ syntax currently)
|
2023-07-25 12:20:48 -04:00 |
|
|
|
5da462670f
|
add menu hotkeys and shortcuts
|
2023-07-25 12:19:10 -04:00 |
|
|
|
5d1251df27
|
properly canonicalize filename
|
2023-07-25 12:18:47 -04:00 |
|
|
|
4fd648c11e
|
add copyright message
|
2023-07-25 12:18:00 -04:00 |
|
|
|
a402d2c6d8
|
simplify, move redundant operations to functions, update coding style
|
2023-07-25 10:16:20 -04:00 |
|
|
|
908e925b8f
|
add minimal about dialogs
|
2023-07-25 00:39:47 -04:00 |
|
|
|
a49a1b644e
|
update main widget to CodeEditor with line numbers and highlight. Open file from command line.
|
2023-07-25 00:13:53 -04:00 |
|
|
|
b87ced52b4
|
first minimal stab at LAMMPS GUI
|
2023-07-24 19:07:33 -04:00 |
|
|
|
66403c93ad
|
add preset and support for building serial multi-arch macOS executables
|
2023-07-18 18:55:27 -04:00 |
|
|
|
baac049aed
|
update LAMMPS input file syntax highlighting for recent changes
|
2023-07-15 12:25:03 -04:00 |
|
|
|
378ef4b23e
|
require CMake version 3.16
|
2023-06-30 22:59:41 -04:00 |
|
|
|
62b388b48f
|
consolidate LAMMPS data type constants and enums and use the same names
|
2023-06-10 19:23:11 -04:00 |
|
|
|
ce38bb988d
|
add lammps_last_thermo support to swig, plugin and fortran interface
|
2023-06-08 19:12:59 -04:00 |
|
|
|
8ddac8cf02
|
search through the python folders recursive to detect all pending version tags
|
2023-06-08 12:46:41 -04:00 |
|
|
|
f015aaff84
|
compile time compatibility with swig 4.1
|
2023-05-10 16:54:05 -04:00 |
|
|
|
2542a7e840
|
avoid integer overflow
|
2023-05-03 00:39:59 -04:00 |
|
|
|
89d59fad61
|
Merge branch 'develop' into collected-small-fixes
|
2023-05-02 20:47:33 -04:00 |
|
|
|
81523b7ba3
|
Merge branch 'patch-2' of github.com:srtee/lammps into collected-small-fixes
|
2023-05-02 17:42:02 -04:00 |
|
|
|
a8dcb3987a
|
silence compiler warning
|
2023-05-02 17:29:06 -04:00 |
|
|
|
7b5fecfad7
|
make phana installation in LAMMPS compatible with ubuntu 18.04LTS
|
2023-05-02 17:24:38 -04:00 |
|
|
|
8ca1e2d417
|
add OpenMP suppression for GNU 13 compilers
|
2023-05-02 11:50:15 -04:00 |
|
|
|
39a77064e0
|
update so it can be built either standalone or as subdir with LAMMPS
|
2023-05-01 20:14:52 -04:00 |
|
|
|
478058119b
|
integrate CMake build procedure for tools/phonon
|
2023-05-01 20:14:52 -04:00 |
|
|
|
8d6c3a7536
|
Fix Markdown table in tools/tabulate/README.md
|
2023-04-28 14:50:09 +10:00 |
|
|
|
9f11cac393
|
updated apptainer build definitions for almalinux 8/9
|
2023-04-24 20:41:06 -04:00 |
|
|
|
3950765e8f
|
Add missing hipfft-dev to ROCm containers
|
2023-04-06 22:44:07 -06:00 |
|
|
|
ea7e75798d
|
include an additional latex package and an nsis plugin for building everything
|
2023-03-29 11:58:05 -04:00 |
|
|
|
ecc6269648
|
add useful comments
|
2023-03-20 10:52:20 -04:00 |
|
|
|
9f22974209
|
Merge branch 'develop' of github.com:agiliopadua/lammps into collected-small-changes
|
2023-03-20 10:50:05 -04:00 |
|
|
|
3280d6b786
|
Fixed bug in fep tools
|
2023-03-20 14:47:40 +01:00 |
|
|
|
a320f24247
|
Fixed bug in fep tools
|
2023-03-20 14:46:01 +01:00 |
|
|
|
57e86346a6
|
fix bug where floating point data was formatted as integer since the second column was assumed to be the type
|
2023-03-19 18:20:31 -04:00 |
|
|
|
21293f1c08
|
update links and hashes for new plumed2 releases
|
2023-03-13 12:10:41 -04:00 |
|
|
|
2b6c2e07a4
|
add -help flag and help message output. step version number. update docs.
|
2023-03-10 21:26:40 -05:00 |
|
|
|
80233f353f
|
port UTF-8 to ASCII substitution to msi2lmp and apply to reading .frc files
|
2023-03-10 20:56:55 -05:00 |
|
|
|
2dad2586f1
|
update help message
|
2023-03-10 20:16:39 -05:00 |
|
|
|
fc4ca0503e
|
make --rdffile, --units, and --temperature required arguments
|
2023-03-03 20:51:28 -05:00 |
|
|
|
c3c6c5f154
|
python2 compatibility (or rather scipy of python2) and avoid NaNs
|
2023-03-03 20:50:56 -05:00 |
|
