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Diffusion lammps (lammm-master-deprecated) Graph

lammps/src/USER-OMP
lammm-master-deprecated

History Graph

CommitAuthorDetailsCommitted
14554c93af5astamoor
Fixing compile error in USER-OMP 
Aug 31 2015
4bd3fe89c88dsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13971 f3b2605a-c512-4ea7… 
Aug 30 2015
4e247c3b8cc1sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13951 f3b2605a-c512-4ea7… 
Aug 29 2015
ce59e32d1cf6sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13937 f3b2605a-c512-4ea7… 
Aug 28 2015
eb97abc636d5Axel Kohlmeyer
make USER-TALLY package compatible with USER-OMP. add another safeguard against… 
Aug 26 2015
59ce36fa360dAxel Kohlmeyer
fix nasty USER-OMP bug for systems with few atoms 
Aug 26 2015
ace1f1eb75b7Axel Kohlmeyer
remove unused flag from package omp command 
Aug 26 2015
5049cb79a295Axel Kohlmeyer
remove broken and unused pppm/tip4p/cg kspace style 
Aug 26 2015
0edf3cbd318fAxel Kohlmeyer
remove dead code spotted by coverity scan. CID 134537 
Aug 18 2015
c1f734b5740aAxel Kohlmeyer
correct respa/omp style for hybrid respa 
Jul 17 2015
c3fd41010d41sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13464 f3b2605a-c512-4ea7… 
May 15 2015
f084911239b0Axel Kohlmeyer
fix known inconsistencies with exclusions for coul/dsf styles 
May 14 2015
8b35e3a57a45Axel Kohlmeyer
bugfix. forgot opening brace on if statement. 
Apr 7 2015
b1f947e54899Axel Kohlmeyer
avoid segfault when omp package enabled but inactive 
Apr 7 2015
9435c9dcb15asjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13320 f3b2605a-c512-4ea7… 
Mar 27 2015
22ba332a6036Axel Kohlmeyer
need to fix up USER-CUDA related dependency handling for both install and… 
Mar 11 2015
d3a1cb667562Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Feb 9 2015
743148df5038stamoor
Fixing compile problem 
Feb 6 2015
79cfbf031ac8sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13072 f3b2605a-c512-4ea7… 
Feb 6 2015
708eba5a1af8Axel Kohlmeyer
bugfix for rigid styles in USER-OMP. 
Feb 2 2015
5b10a7236b01sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13017 f3b2605a-c512-4ea7… 
Feb 2 2015
e59417b0f71bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12979 f3b2605a-c512-4ea7… 
Jan 21 2015
d931df54fe33Axel Kohlmeyer
need to delete some dependencies when uninstalling USER-CUDA and USER-OMP 
Jan 20 2015
8d532d93e929Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Jan 20 2015
4a975dd8cf07sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12957 f3b2605a-c512-4ea7… 
Jan 20 2015
72ac6ea85400sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12956 f3b2605a-c512-4ea7… 
Jan 20 2015
4957e4a147d6sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12951 f3b2605a-c512-4ea7… 
Jan 19 2015
1eb5be159143sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12950 f3b2605a-c512-4ea7… 
Jan 19 2015
fc6be0ef348aAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Jan 12 2015
e6a53b3f3b6fsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12921 f3b2605a-c512-4ea7… 
Jan 9 2015
5838c3c5428eAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Jan 6 2015
ddeb3f59c139sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12874 f3b2605a-c512-4ea7… 
Jan 5 2015
2d2210133fb8Axel Kohlmeyer
work around confused OpenMP compilers 
Nov 19 2014
416f6c25e56dAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Nov 18 2014
21ac09ad9c9csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12715 f3b2605a-c512-4ea7… 
Nov 18 2014
7518fae9bcffsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12641 f3b2605a-c512-4ea7… 
Oct 21 2014
f350cc4ec77bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12637 f3b2605a-c512-4ea7… 
Oct 20 2014
9613feca98e9Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Oct 17 2014
4a31f062c434sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12635 f3b2605a-c512-4ea7… 
Oct 14 2014
9d25e7e8ecbaAxel Kohlmeyer
temporarily disable known to be broken pair style 
Oct 14 2014
b460be7fbbf0Axel Kohlmeyer
add support for dynamic charges which require updating qsum and qsqsum 
Oct 9 2014
a05fa107d8ffAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Oct 9 2014
dd4f79e2b8dbathomps
Added rhomax assignment 
Oct 8 2014
d52414244a9cAxel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Sep 10 2014
f9684d5076fcsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12459 f3b2605a-c512-4ea7… 
Sep 10 2014
4374200a779esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12458 f3b2605a-c512-4ea7… 
Sep 10 2014
b843c808a503sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12455 f3b2605a-c512-4ea7… 
Sep 9 2014
777e82995de2sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12406 f3b2605a-c512-4ea7… 
Sep 5 2014
c0b4b4648595Axel Kohlmeyer
make use of restricted pointer consistent across OPT package. 
Aug 26 2014
4ea728dc8007sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12348 f3b2605a-c512-4ea7… 
Aug 25 2014
4ea7121035deAxel Kohlmeyer
remove obsolete preprocessor define 
Aug 24 2014
ca6b61d07f79Axel Kohlmeyer
remove definitions obsoleted by changes to lmptype.h 
Aug 23 2014
918ace3e2877Axel Kohlmeyer
fix up compilation with alignment and restrict keyword 
Aug 23 2014
39a94bfbdca2Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Aug 19 2014
0f6eb0877ebcsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12310 f3b2605a-c512-4ea7… 
Aug 14 2014
1093ff46f185Axel Kohlmeyer
delete unused variables and reduce compiler warnings 
Aug 10 2014
4c79bce7f1cbAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Aug 10 2014
c1e12f950867sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12285 f3b2605a-c512-4ea7… 
Aug 8 2014
9026afed5cf9sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12284 f3b2605a-c512-4ea7… 
Aug 8 2014
a67fb36bab47Axel Kohlmeyer
add test for invalid box dimension to demystify PPPM out of range errors 
Aug 5 2014
fe1ade5fad2bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12231 f3b2605a-c512-4ea7… 
Jul 30 2014
a44e538ac67fAxel Kohlmeyer
transfer changes from upstream to USER-OMP version 
Jul 1 2014
bcec3c56e45eAxel Kohlmeyer
Merge branch 'patch_14_06_2014' into lammps-icms 
Jun 15 2014
598be75009d2Axel Kohlmeyer
anticipate 14 June 2014 patch 
Jun 15 2014
3f98c4d07662sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12127 f3b2605a-c512-4ea7… 
Jun 14 2014
e8ec5114a9e5sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12010 f3b2605a-c512-4ea7… 
May 22 2014
ffd2b394712esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12009 f3b2605a-c512-4ea7… 
May 22 2014
e60487065649Axel Kohlmeyer
properly implement optimized version of lj/charmm/coul/long/soft 
May 22 2014
c1e8a7b16d04Axel Kohlmeyer
energy calculation was wrong in the last commit. fixed it. 
May 21 2014
3afe9d6aedfaAxel Kohlmeyer
bugfix and cleanup for lj/charmm/coul/long/omp 
May 21 2014
e222e8b16c1bAxel Kohlmeyer
import new files for USER-FEP and /omp version. 
May 21 2014
23892d4fc5bfsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12003 f3b2605a-c512-4ea7… 
May 19 2014
1d825a887cb6Axel Kohlmeyer
fix compile errors/warnings introduced by may 13 patch 
May 14 2014
a93cebcc2d06sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11953 f3b2605a-c512-4ea7… 
May 9 2014
55365522a988Axel Kohlmeyer
big dead code cleanup of comb3 pair style 
May 8 2014
8bee4ef5966asjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11907 f3b2605a-c512-4ea7… 
May 2 2014
0e4643fc5925Axel Kohlmeyer
fix problems flagged by compiler warnings 
Apr 30 2014
0fbda306f930Axel Kohlmeyer
next batch of code cleanup based on compiler warnings 
Apr 30 2014
e6c72491430dAxel Kohlmeyer
another round of removing unused variables 
Apr 29 2014
ee041356397aAxel Kohlmeyer
add multi-threaded versions of the USER-FEP package 
Apr 21 2014
e0256a6447d2Axel Kohlmeyer
get rid of compiler warnings when compiling w/o OpenMP 
Apr 21 2014
ac5b911e5e4fAxel Kohlmeyer
eliminate dead code in newly added features 
Apr 19 2014
f461504c9398sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11829 f3b2605a-c512-4ea7… 
Apr 18 2014
ee04f975b3daAxel Kohlmeyer
some more dead code removal. number of warnings getting small now 
Apr 18 2014
9374001aadd4Axel Kohlmeyer
next batch of unused variable removal 
Apr 16 2014
492e027896e6Axel Kohlmeyer
some more cleanups based on warnings from newer gcc 
Apr 16 2014
1fac1d41fa78sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11789 f3b2605a-c512-4ea7… 
Apr 15 2014
4b2476a4fd7fAxel Kohlmeyer
handle parenthesis to signal assigment warning for manybody potentials 
Apr 13 2014
5f4db57b19c4Axel Kohlmeyer
another set of dead code removal 
Apr 13 2014
d7bbb795fff0Axel Kohlmeyer
spelling fix 
Apr 12 2014
323e3075c413Axel Kohlmeyer
remove even more unused variables and have consistent initialization 
Apr 12 2014
09168613150esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11777 f3b2605a-c512-4ea7… 
Apr 11 2014
1b6af8196fc1sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11775 f3b2605a-c512-4ea7… 
Apr 11 2014
4d46b70ccea8Axel Kohlmeyer
implement changes that follow the equivalent files in upstream 
Apr 11 2014
c5af763730fbAxel Kohlmeyer
silence some more compiler warnings 
Apr 10 2014
5fcfc9f575fcAxel Kohlmeyer
various little cleanups to silence compiler warnings 
Apr 10 2014
5bb50f88412aAxel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Apr 10 2014
5e0b58212ea2sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11746 f3b2605a-c512-4ea7… 
Apr 9 2014
cd3dbc40fd24sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11745 f3b2605a-c512-4ea7… 
Apr 9 2014
8bf5d7181746Axel Kohlmeyer
more explicit error message to state incompatibility of COMB3 with USER-OMP 
Apr 9 2014
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