Commit Graph

3892 Commits

Author SHA1 Message Date
4d0a6d83bd Merged Axel's suggestions and updated text 2017-01-06 11:51:42 +01:00
958722573f Merge branch 'github-tutorial-update' of https://github.com/Pakketeretet2/lammps into github-tutorial-update 2017-01-06 11:44:16 +01:00
9d46670972 Updated text and images on reverse pull requests 2017-01-06 11:44:14 +01:00
1a9f2df3d0 Updated text and images on reverse pull requests 2017-01-06 11:44:00 +01:00
fe14158c10 some formatting updates and text rewrites in the "do not use git add -a" section 2017-01-04 13:13:56 -05:00
0bcbcca140 Highlighted the assignee, maintainer changes, and mentioned LAMMPS collaborator 2017-01-04 17:28:22 +01:00
933b288ce9 Added explaination for assignee, changes pushed by others and collaborator. 2017-01-04 14:31:23 +01:00
4f45d39ac7 Add warning formatting
Any paragraph starting with IMPORTANT NOTE: is transformed into a warning.
2017-01-03 02:34:11 +01:00
7d057d4c83 make it more explicit, that master needs to be updated and feature branches should be created from master 2017-01-02 13:02:48 -05:00
4f096dbad5 Updated some inconsistent text. 2017-01-02 18:53:28 +01:00
18b12efc9f Small changes to tutorial text. 2017-01-02 18:25:36 +01:00
2c7fea1e0d Second update round to text and images, a third will follow after succesful merge. 2017-01-02 18:15:08 +01:00
4d98bbdfa5 Almost done with the tutorial now 2017-01-02 18:08:14 +01:00
391ab761a4 Finally updated the github tutorial. 2017-01-02 17:55:02 +01:00
aa146e9b38 Moved fix_nvk to USER-MISC, updated documentation to reflect move 2016-12-28 19:06:35 +01:00
68814d4fc8 Made documentation changes to fix nvk 2016-12-28 16:26:05 +01:00
616ca1de03 Fix nvk implemented. 2016-12-28 16:17:07 +01:00
925f42727f Fix typo 2016-12-27 14:26:43 -05:00
f553e230db Update Colvars library to version 2016-12-22
Significant code cleanup and several fixes (walls + extended Lagrangian)

New harmonicWalls bias to apply confining boundaries with time-dependent force
constant & integration
2016-12-27 13:17:34 -05:00
781daad2a0 USER-DPD: update documentation for changes in commit 3faa57 2016-12-22 17:31:17 -05:00
62dea1bb63 21Dec16 patch 2016-12-21 09:53:32 -07:00
81a2db8a0c 17Dec16 patch 2016-12-16 11:36:54 -07:00
3027ac9250 patch 16Dec16 2016-12-16 10:30:57 -07:00
e364b80724 added length keyword to python command 2016-12-16 10:24:25 -07:00
f509f133af patch 13Dec16: neighbor refactor, Stan pppm/disp bug fix, M Brown INTEL package updates 2016-12-13 17:14:28 -07:00
f3b355bcbe Merge pull request #298 from akohlmey/collected-small-fixes
Collected small fixes
2016-12-13 16:23:23 -07:00
ae5764beac added functionity to lib interface 2016-12-13 16:22:17 -07:00
ddf678da51 make fix gcmc command overview consistent
this closes #296
2016-12-09 14:30:27 -05:00
d3d5ac17bf Fixed small typos in doc 2016-12-07 19:37:51 -08:00
fb3f597f41 30Nov16 patch 2016-11-30 14:04:41 -07:00
d14814ae2e Merge pull request #289 from akohlmey/collected-updates-and-bugfixes
Collected updates and bugfixes
2016-11-30 14:02:41 -07:00
beb5a30f67 new compute global/atom command, also bug fix for descending dump sorts 2016-11-30 14:01:27 -07:00
42d430168b fix typo in compute cluster/atom docs
this closes #292
2016-11-29 07:24:09 -05:00
02ae2d218a correct broken link to USER-SMD docs PDF 2016-11-28 11:34:22 -05:00
87781771ba fix typo and USER-OMP support omission 2016-11-23 09:02:32 -05:00
59d100ab57 final prep for 22Nov patch 2016-11-22 09:23:02 -07:00
b6f2f0e6e9 Merge pull request #287 from rbberger/pylammps/docs
Created PyLammps documentation
2016-11-22 08:50:29 -07:00
ff0441ac16 Merge pull request #286 from akohlmey/small-fixes-and-updates
Collected small fixes and updates
2016-11-22 08:49:46 -07:00
41907d3110 Merge pull request #285 from akohlmey/fix-ipi-update
update for fix ipi from michele ceriotti
2016-11-22 08:48:27 -07:00
b95f255af4 small changes to temper/grem commands 2016-11-22 08:47:44 -07:00
87a5a35bad A tiny bugfix for the reset flag, and a brief explanation of the changes 2016-11-20 00:44:23 +01:00
230b29eae6 correct accelerator flags for dpd styles in pair style overview 2016-11-19 11:47:12 -05:00
2383c31f15 Created PyLammps documentation
Based on material presented during MD Workshop at Temple University in
August 2016.
2016-11-18 23:58:57 -07:00
176cde8ed3 minor cleanups 2016-11-18 15:36:38 -05:00
2862c20815 Merge branch 'master' into grem-feature 2016-11-18 14:51:46 -05:00
78e018829f Merge branch 'grem-feature' of https://github.com/dstelter92/lammps into grem-feature 2016-11-18 14:48:47 -05:00
4b51719e67 new 17Nov16 patch and stable 2016-11-17 16:51:35 -07:00
25d7be5f3d compute pressure doc change 2016-11-17 16:11:30 -07:00
74c0e4dd5c Merge pull request #278 from akohlmey/pair-agni
Implementation of the AGNI manybody potential
2016-11-17 09:04:31 -07:00
073e8a0524 Merge pull request #276 from akohlmey/doc-updates
Small bugfixes and updates
2016-11-17 09:02:27 -07:00