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Diffusion lammps (efficient_neuronet) Graph

lammps/src
efficient_neuronet

History Graph

CommitAuthorDetailsCommitted
6981237880d9Axel Kohlmeyer
undo local customiztions to USER-ATC in order to simplify the merge with… 
Nov 21 2014
3d3a85df2b38sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12763 f3b2605a-c512-4ea7… 
Nov 20 2014
16fbe2f70f68sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12759 f3b2605a-c512-4ea7… 
Nov 20 2014
2fecb0f4b838jatempl
ATC version 2.0, date: Nov20 
Nov 20 2014
50459a7034e7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12755 f3b2605a-c512-4ea7… 
Nov 20 2014
d476b251e929sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12753 f3b2605a-c512-4ea7… 
Nov 20 2014
7f8f2fd3ed14sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12752 f3b2605a-c512-4ea7… 
Nov 20 2014
6f05cb448353Axel Kohlmeyer
put back c++ emacs cookies 
Nov 20 2014
1a462cba2f1bAxel Kohlmeyer
another batch of dead code removal and cleanups 
Nov 20 2014
4216949d5ef3Axel Kohlmeyer
adapt code to recent changes in variable.cpp 
Nov 20 2014
9d80b115dc4dAxel Kohlmeyer
more dead code removal 
Nov 20 2014
973b24564e7esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12751 f3b2605a-c512-4ea7… 
Nov 20 2014
d9a0df6c9700Axel Kohlmeyer
minor cleanup 
Nov 20 2014
00a18085eb15Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Nov 20 2014
f51b6d103b77stamoor
Restoring qeq files 
Nov 19 2014
72a1dc1552f1stamoor
Fixing bug in qeq 
Nov 19 2014
7eca5edcae58sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12743 f3b2605a-c512-4ea7… 
Nov 19 2014
2d840c556ba0sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12742 f3b2605a-c512-4ea7… 
Nov 19 2014
59c9f7af480csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12741 f3b2605a-c512-4ea7… 
Nov 19 2014
a88834698ea7Axel Kohlmeyer
collected USER-CUDA and KOKKOS updates to address compiler warnings 
Nov 19 2014
af45b7c19b83Axel Kohlmeyer
anticipate bugfixes from 22 Nov 2014 patch 
Nov 19 2014
edb95fc5cd25sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12737 f3b2605a-c512-4ea7… 
Nov 19 2014
23a756c86e7esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12735 f3b2605a-c512-4ea7… 
Nov 19 2014
a7c5a1661d25sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12734 f3b2605a-c512-4ea7… 
Nov 19 2014
526b81b955c0sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12731 f3b2605a-c512-4ea7… 
Nov 19 2014
4dd5a263cd59Axel Kohlmeyer
bugfix from agilio 
Nov 19 2014
8f5063b26e7bAxel Kohlmeyer
dead code removal and format cleanups 
Nov 19 2014
2d2210133fb8Axel Kohlmeyer
work around confused OpenMP compilers 
Nov 19 2014
3b4f52bc9399Axel Kohlmeyer
fix array dimensioning bug 
Nov 19 2014
d865a1d8e56fAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Nov 19 2014
aaa76b5649aestamoor
Fixing bug 
Nov 19 2014
74adae232eb4sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12729 f3b2605a-c512-4ea7… 
Nov 19 2014
fcaaf75764f7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12727 f3b2605a-c512-4ea7… 
Nov 19 2014
14199b85f91esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12724 f3b2605a-c512-4ea7… 
Nov 18 2014
e4c84f31caaasjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12720 f3b2605a-c512-4ea7… 
Nov 18 2014
48e1a950b9f7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12718 f3b2605a-c512-4ea7… 
Nov 18 2014
200743f865cbAxel Kohlmeyer
avoid virtual function overloading mismatch 
Nov 18 2014
b0a5f4a28054sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12717 f3b2605a-c512-4ea7… 
Nov 18 2014
416f6c25e56dAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Nov 18 2014
980ef3753512sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12716 f3b2605a-c512-4ea7… 
Nov 18 2014
21ac09ad9c9csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12715 f3b2605a-c512-4ea7… 
Nov 18 2014
f14e5cdce67bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12714 f3b2605a-c512-4ea7… 
Nov 18 2014
87cdaaa1239csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12711 f3b2605a-c512-4ea7… 
Nov 18 2014
5e1af15a1003sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12710 f3b2605a-c512-4ea7… 
Nov 18 2014
32699b098348sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12709 f3b2605a-c512-4ea7… 
Nov 18 2014
dbdde74aab16sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12707 f3b2605a-c512-4ea7… 
Nov 17 2014
c404148cb9acsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12706 f3b2605a-c512-4ea7… 
Nov 17 2014
3c59b58794a8sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12704 f3b2605a-c512-4ea7… 
Nov 17 2014
f39815a416a3sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12700 f3b2605a-c512-4ea7… 
Nov 17 2014
9f94910670easjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12698 f3b2605a-c512-4ea7… 
Nov 17 2014
f58e7cd6cc9asjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12695 f3b2605a-c512-4ea7… 
Nov 17 2014
b7ece0fb5183sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12693 f3b2605a-c512-4ea7… 
Nov 17 2014
8014e5cf0d4eAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Nov 6 2014
a5a013ed1a96sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12679 f3b2605a-c512-4ea7… 
Nov 5 2014
d586a4bbbbe3sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12678 f3b2605a-c512-4ea7… 
Nov 5 2014
8e4bd5255a80Axel Kohlmeyer
import bugfix from trung for computing per atom virial with pppm/gpu 
Nov 3 2014
1e0d8a1e14aaAxel Kohlmeyer
bugfix/update 
Nov 1 2014
4a07b74790ceAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Oct 31 2014
fdd3c860d077sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12675 f3b2605a-c512-4ea7… 
Oct 30 2014
664cf51d7bc3sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12673 f3b2605a-c512-4ea7… 
Oct 30 2014
87b86eda4c4dsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12670 f3b2605a-c512-4ea7… 
Oct 30 2014
731f4e46746dsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12669 f3b2605a-c512-4ea7… 
Oct 30 2014
13f65f7f1827sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12666 f3b2605a-c512-4ea7… 
Oct 30 2014
ec9ca628445esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12665 f3b2605a-c512-4ea7… 
Oct 30 2014
bbdb288175ccsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12664 f3b2605a-c512-4ea7… 
Oct 30 2014
04fc77f85ddasjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12662 f3b2605a-c512-4ea7… 
Oct 30 2014
88d6e13898cesjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12661 f3b2605a-c512-4ea7… 
Oct 30 2014
0b0d5f2e86f2Axel Kohlmeyer
restore some required code when deleting dead code 
Oct 30 2014
f35a86e7c0e4Axel Kohlmeyer
grow_arrays() was called too early. 
Oct 30 2014
a8e2433a2aefAxel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Oct 30 2014
6d387b4aaff9Axel Kohlmeyer
make the fix phonon code more standard compliant 
Oct 30 2014
2507679103d3Axel Kohlmeyer
update proxy revision id 
Oct 29 2014
155260799895sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12658 f3b2605a-c512-4ea7… 
Oct 29 2014
711e9ea3a1ecsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12656 f3b2605a-c512-4ea7… 
Oct 29 2014
7d2b884023f7Axel Kohlmeyer
cosmetic change 
Oct 29 2014
12dcd704610dAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Oct 29 2014
1fbc2e928d1csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12652 f3b2605a-c512-4ea7… 
Oct 28 2014
9f3c85870b4esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12651 f3b2605a-c512-4ea7… 
Oct 28 2014
27f5998d9306Axel Kohlmeyer
another synchronization with colvars git repo 
Oct 27 2014
f7d5f002f677Axel Kohlmeyer
update colvars library from git repo again 
Oct 27 2014
501d810234eeAxel Kohlmeyer
bugfix/workaround for multi-style neighbor list builds with GPU acceleration 
Oct 26 2014
294a1dc84f59Axel Kohlmeyer
do not fail, if log.cite cannot be written (to). 
Oct 26 2014
f4718e986164Axel Kohlmeyer
more colvars updates. now prints interface version date,too. 
Oct 26 2014
ca928af3bd19Axel Kohlmeyer
user-reaxc bugfix from ray 
Oct 24 2014
2eb98b704b11Axel Kohlmeyer
gpu library updates from trung 
Oct 24 2014
c47c1428c211Axel Kohlmeyer
synchronize with the colvars git repo again 
Oct 22 2014
ff0d7028fef5Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Oct 22 2014
83c08fab776dAxel Kohlmeyer
add basic multi-replica support for colvars 
Oct 21 2014
e806e4d2669fsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12643 f3b2605a-c512-4ea7… 
Oct 21 2014
e64b937a4303sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12642 f3b2605a-c512-4ea7… 
Oct 21 2014
7518fae9bcffsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12641 f3b2605a-c512-4ea7… 
Oct 21 2014
4ffd3808e0f4sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12639 f3b2605a-c512-4ea7… 
Oct 21 2014
35d8036e3236Axel Kohlmeyer
update C++ headers with emacs mode cookies 
Oct 21 2014
7834baffe4c2Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Oct 21 2014
112ea4cd2b74Axel Kohlmeyer
disallow using fixes from the QEQ package with newton pair off 
Oct 21 2014
2411d6363822Axel Kohlmeyer
update Makefile.shlib to be in sync with the standard makefile 
Oct 20 2014
6ccfab428dabAxel Kohlmeyer
update some custom makefiles for recent changes in build system 
Oct 20 2014
f350cc4ec77bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12637 f3b2605a-c512-4ea7… 
Oct 20 2014
2930738444f4Axel Kohlmeyer
need to resize per atom arrays after we know whether extended flags are used 
Oct 20 2014
9613feca98e9Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Oct 17 2014
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