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9f733fb305
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Removed unused variables
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2020-07-04 00:23:34 -05:00 |
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6de020805f
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Fixed a bug with tersoff/gpu with building the short neighbor list
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2020-07-03 23:55:26 -05:00 |
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66271448ae
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Merge pull request #2167 from Vsevak/master
Update GPU CMake and Makefile scripts for ROCm v3.5
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2020-06-26 13:43:32 -04:00 |
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3c19a49605
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Merge pull request #2190 from akohlmey/more-fmtlib-uses
Reduce use of local print buffers, simplify output handling with std::string and fmtlib
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2020-06-26 12:08:46 -04:00 |
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d46a1254e4
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remove non-ASCII characters.
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2020-06-25 21:11:32 -04:00 |
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496bd55dc9
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Fix lj/cut/tip4p/long/gpu virial
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2020-06-25 17:30:51 +03:00 |
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0ba701acd7
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Remove trailing space
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2020-06-20 17:25:16 +03:00 |
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723b9e6760
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Try to keep compatibility with deprecated ROCm hcc compiler
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2020-06-20 15:17:54 +03:00 |
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8eed1b27ff
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GPU Makefile cleanup
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2020-06-19 00:07:10 +03:00 |
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f75b8e1688
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Fix Makefile for GPU ROCm 3.5 backend
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2020-06-18 00:33:46 +03:00 |
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a7967f8b3f
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Merge remote-tracking branch 'origin/master'
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2020-06-17 23:31:06 +03:00 |
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9aee8d41bd
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Merge branch 'master' into collected-small-changes
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2020-06-15 12:12:45 -04:00 |
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622db7053e
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Merge remote-tracking branch 'origin/master'
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2020-06-15 18:38:40 +03:00 |
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4042b836c2
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enable full c++11 in colvars, same as LAMMPS
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2020-06-14 12:18:51 -04:00 |
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92d54d2764
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not portable to use "mpi"
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2020-06-12 09:01:59 -04:00 |
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cf359dede2
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Merge pull request #2139 from akohlmey/fetch-potentials
Add feature to transparently download external potential files when packages are enabled
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2020-06-12 06:28:42 -04:00 |
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d61d8899ff
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Merge branch 'fetch-potentials' into feature-cnt
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2020-06-12 05:54:45 -04:00 |
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cf5c748fb4
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Merge branch 'master' into feature-cnt
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2020-06-12 05:53:17 -04:00 |
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d1546262a4
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replace non-standard tabs with blanks
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2020-06-12 05:15:23 -04:00 |
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74df1bcf7d
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update makefiles and add dependencies for parallel compile
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2020-06-12 05:07:19 -04:00 |
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77a38c2a0a
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remove (unsupported) reference to AMD Ryzen
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2020-06-11 17:03:20 -04:00 |
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64a4e5e21a
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make kokkos configuration keywords in traditional build case insensitive
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2020-06-10 15:53:09 -04:00 |
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6891fa2610
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update a few URLs to use https: instead of http:
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2020-06-10 12:34:09 -04:00 |
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9bf47cd9f3
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make KOKKOS library compilation compatible with mode=shared
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2020-06-05 13:58:11 -04:00 |
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bddd6d5e84
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update
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2020-05-19 23:19:49 -04:00 |
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ed43c1e22b
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Merge branch 'master' into feature-cnt
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2020-05-18 18:23:16 -04:00 |
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e26be18b1e
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update
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2020-05-18 17:28:48 -04:00 |
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3b77546eb9
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Merge pull request #2069 from junghans/latte_v1.2.2
latte: bump to v1.2.2
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2020-05-07 14:27:19 -04:00 |
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69a6a8e064
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pull in kokkos-3.1.01
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2020-05-07 10:22:42 -06:00 |
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fe62e1dbc9
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latte: bump to v1.2.2
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2020-05-05 10:51:11 -06:00 |
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fdb4ba51da
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add patch to VORONOI package external build so it will compile with BSD make
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2020-05-03 04:04:02 -04:00 |
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e8d4cc424e
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use different header for alloca(3) on *BSD
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2020-05-03 01:10:04 -04:00 |
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74e8505a1f
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Merge branch 'master' into collected-small-changes
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2020-04-27 16:57:47 -04:00 |
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121b40ebaa
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Merge pull request #2026 from ndtrung81/ellipsoid-gpu-special-bonds
Fixed bugs with special bonds for ellipsoid gpu pair styles
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2020-04-27 16:15:58 -04:00 |
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0a9bed0ca6
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Merge branch 'cmake_clean_up_plumed' of github.com:junghans/lammps into collected-small-changes
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2020-04-27 16:07:52 -04:00 |
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437967bfd8
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adding the standard header to prevent ‘NULL’ was not declared error
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2020-04-27 12:49:03 -05:00 |
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f1aaad2b13
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remove trailing whitespace
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2020-04-27 09:54:05 -04:00 |
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d53e468ce0
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do not mix c++ style and c-style comments
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2020-04-26 22:50:24 -04:00 |
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0b6e5be379
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cosmetic edit to trigger new CI test runs
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2020-04-26 00:25:07 -04:00 |
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7fd50045fe
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USER-PLUMED: remove unused defines
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2020-04-25 10:16:58 -06:00 |
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1295a9ef46
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Fixed bugs with special bonds for ellipsoid gpu pair styles
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2020-04-25 10:28:18 -05:00 |
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ba8d043c7e
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Update Kokkos library in LAMMPS to v3.1
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2020-04-16 09:06:08 -06:00 |
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be1f307384
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Add defines to build Lepton with MSVC and traditional make
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2020-04-14 16:57:04 -04:00 |
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209a3fde71
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use MY_PI everywhere, not M_PI.
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2020-04-13 12:02:53 -04:00 |
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5d2ec73c5d
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re-enable cross-compilation with mingw64
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2020-04-13 11:22:19 -04:00 |
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0608002451
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Remove trailing whitespace
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2020-04-10 15:10:41 -04:00 |
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438ee4d75b
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Merge remote-tracking branch 'origin/master' into gpu_hip
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2020-04-08 13:49:41 -04:00 |
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72200a9958
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Fix MPI environment variable issue in Makefile.kokkos
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2020-04-01 08:57:18 -06:00 |
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19a52dc506
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Update lib/gpu/.gitignore
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2020-03-30 17:36:22 -04:00 |
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373b57cfdc
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Change 'echo -e' to 'printf' for greater compatibility
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2020-03-30 17:36:00 -04:00 |
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