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4251c70e93
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update list of false positives for spellchecking
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2018-11-20 00:08:07 -05:00 |
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0bcb1bd301
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more spelling fixes and occational re-edits
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2018-11-20 00:06:40 -05:00 |
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c6c00ee7ee
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more spelling fixes
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2018-11-19 20:46:32 -05:00 |
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b34dac41c2
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port documentation spelling fixes to comments or strings in source code.
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2018-11-19 16:15:24 -05:00 |
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13ae678f39
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more manual spelling fixes
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2018-11-19 16:13:57 -05:00 |
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8a94a32551
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avoid duplicate label
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2018-11-19 15:19:23 -05:00 |
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b6f0fe4c2d
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more changes for correct and consistent spelling in the manual
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2018-11-19 11:47:33 -05:00 |
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809bd855b6
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adjust wording of non-features discussion to be more in-sync with recent developments
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2018-11-19 11:24:55 -05:00 |
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4dc2f9c6c4
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fix some spelling errors in the manual
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2018-11-19 11:24:17 -05:00 |
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c49c35e41d
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avoid tuncation error through integer division and promote to use "bigint" instead of "int" to avoid overflows for large systems
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2018-11-17 06:40:33 -05:00 |
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1597e78d5a
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guarantee initialization of hyperflag
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2018-11-17 06:39:28 -05:00 |
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a7bfb30043
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update atc/cauchy_born examples with missing files
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2018-11-16 23:03:47 -05:00 |
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bbcb659158
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render fix commands in 6 columns instead of 8 so only narrow screens need to scroll horizontally
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2018-11-16 22:09:07 -05:00 |
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dc6054fc2d
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rename "All commands" headers to "General commands"
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2018-11-16 22:04:35 -05:00 |
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0264edfcec
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provide example for how to set Tdamp correctly to 100 timesteps for all choices of unit
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2018-11-16 16:27:47 -05:00 |
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a66384cfea
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update github tutorial/howto for recent changes in the development workflow
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2018-11-16 16:27:05 -05:00 |
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fd4262805d
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for enabling MPIIO we also need to set -DLMP_MPIIO
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2018-11-16 15:48:35 -05:00 |
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cf79751f4f
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Merge pull request #1207 from akohlmey/next-patch-release
Patch release 15 November 2018
patch_15Nov2018
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2018-11-15 19:33:52 -05:00 |
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e4dee3de17
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Merge pull request #1206 from akohlmey/collected-small-changes
Collected small changes for next release
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2018-11-15 17:29:26 -05:00 |
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6e225d90fc
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fix some minor bugs write data file writing and remove dead code and silence compiler warnings
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2018-11-15 16:50:56 -05:00 |
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1fc3b4618c
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remove dead code and silence compiler warnings
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2018-11-15 16:50:56 -05:00 |
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eae9d27f6d
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OpenMP support from the compiler is not a requirement for USER-OMP. Without OpenMP, it is like the OPT package but for many more styles, so it is still useful and should be supported.
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2018-11-15 16:50:56 -05:00 |
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db29ec7eee
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complete workflow document
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2018-11-15 14:58:02 -05:00 |
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090778c42b
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Merge pull request #1204 from lammps/doc-plumed
Linkage mode improvements and documentation updates for USER-PLUMED package
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2018-11-15 13:48:58 -05:00 |
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db935dba5e
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Merge pull request #1201 from junghans/cmake_doc
cmake: update internal doc about how cmake finds executables
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2018-11-15 13:48:17 -05:00 |
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e160376365
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incomplete first draft. committed for checking the markup in github.
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2018-11-15 12:45:15 -05:00 |
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d5f222464b
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Update README.md
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2018-11-15 09:48:46 -07:00 |
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4d9e2a014b
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add detailed build instructions and discussion of linkage modes for PLUMED library and USER-PLUMED package
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2018-11-15 11:35:04 -05:00 |
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8a4983e4bc
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reformatting and simplification of fix plumed docs
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2018-11-15 10:53:38 -05:00 |
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82d6aa9add
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interlink fixes colvars, plumed, and smd
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2018-11-15 10:52:41 -05:00 |
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4231ab3d57
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correct some links
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2018-11-15 10:52:03 -05:00 |
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25914ea3f3
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patch 15Nov2018
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2018-11-15 10:17:25 -05:00 |
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003bb28471
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make @gtribello code owner of the USER-PLUMED package
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2018-11-14 22:17:25 -05:00 |
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a557644939
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support all three plumed linkage modes with CMake as well. For downloaded and previously installed plumed lib
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2018-11-14 22:13:18 -05:00 |
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04520e627d
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add code and scripts to support all three plumed linkage modes with fix plumed for conventional build
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2018-11-14 21:26:36 -05:00 |
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952e52982e
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add comment to indicate code intended for backward compatibility only
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2018-11-14 05:37:59 -05:00 |
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a942d8b3ba
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use memset() for clearing of arrays
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2018-11-14 05:30:23 -05:00 |
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7a22b8aa62
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check only in currently added data file atoms for dihedral overflow
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2018-11-14 05:29:26 -05:00 |
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4c1fbc359a
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use tagint when unpacking atom tags from communication buffers
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2018-11-14 05:28:19 -05:00 |
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2c644c5f2e
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Merge pull request #1197 from akohlmey/collected-small-fixes
Collection of small changes and bugfixes for the next release
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2018-11-13 15:18:09 -05:00 |
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b1186a971e
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Merge pull request #1202 from lammps/hyper
Add Hyper-dynamics to REPLICA package
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2018-11-13 15:17:30 -05:00 |
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2dbd575a4b
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Merge pull request #1203 from stanmoore1/kk_update
Update Kokkos library in LAMMPS to v2.7.24
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2018-11-13 15:15:09 -05:00 |
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4805e1df22
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doc page additions for USER-PLUMED package
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2018-11-13 08:29:07 -07:00 |
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380f0e4971
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remove some debugging code
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2018-11-13 08:06:40 -07:00 |
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a026ce9669
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correct broken links detected by make mobi
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2018-11-12 21:38:26 -05:00 |
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7e779d16de
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correct broken links in manual reported by 'make html'
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2018-11-12 21:33:37 -05:00 |
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b776f0f29f
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remove dead code and silence warnings about unused parameters
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2018-11-12 21:11:55 -05:00 |
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443644025f
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silence compiler warnings
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2018-11-12 20:50:14 -05:00 |
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c4c90a96ec
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avoid void return from non-void function
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2018-11-12 20:49:01 -05:00 |
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5cb2463204
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c++ style include files do not have a .h extension
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2018-11-12 20:33:30 -05:00 |
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