35d8a3d68e
Document 'Find and Replace' dialog
2024-08-24 14:32:01 -04:00
4d6b998a75
flang may be called flang-new
2024-08-22 00:00:27 -04:00
a92192d16b
automatically include release version in binary package name
2024-08-11 09:58:21 -04:00
62665dd079
Merge pull request #4266 from akohlmey/geturl-command
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New geturl command to download files for LAMMPS inputs on demand
2024-08-08 13:42:21 -04:00
3fa48dfa34
build system integration of geturl
2024-08-07 09:37:33 -04:00
72a0992054
Propagate OpenMP flags to Colvars library
2024-08-06 00:57:12 +02:00
8bc38709a4
raise minimum required version of clang-format and extend search to newer versions
2024-07-31 09:10:43 -04:00
701280a648
lower GSL version requirement for compatibility with more (Linux) systems
2024-07-30 15:20:48 -04:00
b42ccf3a0f
don't check for omp.h if the compiler identifies as Clang since the CMake check seems broken
2024-07-28 12:42:05 -04:00
91931f0ea2
Merge remote-tracking branch 'github/develop' into collected-small-fixes
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# Conflicts:
# doc/src/Tools.rst
2024-07-23 17:04:36 -04:00
9fd21fa065
Remove lammps-shell tool as it has been superseded by LAMMPS-GUI
2024-07-22 06:43:10 -04:00
3017630c01
Merge remote-tracking branch 'github/develop' into collected-small-fixes
2024-07-18 18:40:22 -04:00
1ed6e153b6
Merge pull request #4214 from jtclemm/rheo
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New multiphase fluids package
2024-07-18 18:38:51 -04:00
207d1e20b9
warn about problematic compiler versions and C++ standard combinations
2024-07-15 18:23:59 -04:00
6fedb6a1b8
fix compilation issue with latest QUIP/libAtoms code
2024-07-15 06:48:21 -04:00
87060b2d3e
display selected C++ standard as part of the CMake summary output
2024-07-05 21:37:04 -04:00
c0dfccdd64
add a few more flags to clang-tidy
2024-07-04 11:18:08 -04:00
a4d69878fa
update list of available sanitizers for Fedora 40 and GCC 14
2024-07-03 22:02:35 -04:00
b6d11b5902
document GSL dependency and provide build instructions for RHEO package
2024-07-03 19:07:19 -04:00
9b52888e53
Adding RHEO dependency to cmake
2024-07-03 15:53:38 -06:00
66552d80da
Merge branch 'develop' into rheo
2024-07-03 03:42:44 -04:00
cdb4a331a6
remove INTEL package from cross-compiler config.
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It doesn't do much goos since we're not using an Intel compiler
and we are running out of capacity for auto-exported symbols
for the LAMMPS shared library (limited to 65k).
2024-06-27 06:27:58 -04:00
b219bb8de8
Merge conflicts
2024-06-24 14:09:33 -06:00
487a9ae73e
return to alphabetical order
2024-06-23 03:09:54 -04:00
0e28eb0348
Make sure CMAKE_INSTALL_FULL_LIBDIR is defined when using it
2024-06-22 23:28:05 -04:00
71c5e04121
Merge pull request #4179 from akohlmey/collected-small-changes
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Collected small changes and fixes
2024-06-19 17:39:57 -04:00
cb0af02748
Merge pull request #4193 from akohlmey/extra-command-package
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Create new EXTRA-COMMAND package
2024-06-19 15:06:20 -04:00
778d11c79e
Merge remote-tracking branch 'github/develop' into collected-small-changes
2024-06-19 14:46:04 -04:00
629a9cbe3d
Merge pull request #4188 from Eddy-Barraud/dpd_charged
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add pair styles dpd/coul/slater/long and dpd/coul/slater/long/gpu
2024-06-19 13:50:46 -04:00
9b419b669d
Merge pull request #4192 from gtribello/fix-plumed-cmake
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Update to Plumed interface
2024-06-19 12:03:43 -04:00
ef902b03f9
Merge branch 'develop' into collected-small-changes
2024-06-19 12:02:56 -04:00
4e0bf6137d
Merge pull request #4110 from uf3/ml-uf3
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Implementation of pair_style uf3 and uf3/kk
2024-06-19 11:43:32 -04:00
f4005e350a
update fix plumed API version check and add reminder comments to build files
2024-06-17 07:11:56 -04:00
8eec17d409
add missing file for CMake build
2024-06-13 09:26:23 -04:00
397dc9a7f6
build system and maintenance updates
2024-06-13 09:13:55 -04:00
2aacc017cb
Changes to CMake to hopefully match Sachith's suggestions
2024-06-12 17:29:30 -06:00
d61c94c0f3
move group2ndx and ndx2group to new EXTRA-COMMAND package. update docs.
2024-06-10 14:14:36 -04:00
77c04d3827
cosmetic changes
2024-06-10 09:15:14 -04:00
43ce6b018a
update Plumed support for version 2.8.4 and 2.9.1
2024-06-09 01:30:35 -04:00
34a037ccfb
workaround for xdg-open and incompatible shared libs
2024-06-02 09:41:58 -04:00
345d559a37
Merge branch 'master' into fix-plumed-cmake
2024-05-26 11:51:35 +01:00
3805a01448
Update CMake
2024-05-15 14:42:01 -06:00
9e755cd0af
Merge branch 'lammps:develop' into ml-uf3
2024-05-13 15:10:58 -04:00
a2616630b5
update OpenCL ICD loader source to latest release
2024-05-09 07:18:50 -04:00
42a4e63061
Merge branch 'lammps:develop' into ml-uf3
2024-04-17 16:45:33 -04:00
329d546eea
Merge pull request #4078 from jmgoff/pace-mliap
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Update ML-IAP for ACE support
2024-04-16 22:42:17 -04:00
01b1d047a2
Merge branch 'lammps:develop' into ml-uf3
2024-04-13 18:56:07 -04:00
1b71576b6f
Update CMake and docs
2024-04-05 09:09:44 -06:00
7e09353e7c
add ML-UF3 to compatible CMake preset files
2024-03-27 06:28:23 -04:00
9a23ddf88a
Added ml-uf3 to cmake and make files
2024-03-25 12:08:51 -04:00