Homec4science
Diffusion lammps (lammm-master-deprecated) Graph

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

History Graph

CommitAuthorDetailsCommitted
5c6301f49d25Axel Kohlmeyer
re-implementation of pppm/cg/omp using the new pppm/cg 
Feb 12 2013
7d3df4eefeceAxel Kohlmeyer
bugfixes. tested ok for ik and ad differentiation 
Feb 12 2013
e9413f8ec597Axel Kohlmeyer
re-implementation of /omp support for PPPM 
Feb 12 2013
d2459bc1c552Axel Kohlmeyer
incorporate upcoming changes to tip4p styles from upstream 
Feb 11 2013
a8cb638e765bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9443 f3b2605a-c512-4ea7… 
Feb 11 2013
62434a8a89cbAxel Kohlmeyer
one more integrator with /omp support. 
Feb 10 2013
144c888f6b72Axel Kohlmeyer
implement the remaining rigid integrators with OpenMP support 
Feb 10 2013
9236393b18e9Axel Kohlmeyer
some simplification. comments regarding replicated code added 
Feb 10 2013
718aa55ae3c4Axel Kohlmeyer
better alignment 
Feb 10 2013
005af0243cebAxel Kohlmeyer
next try at having thread safe temperature bias removal/restoration 
Feb 10 2013
e321dc9f5812Axel Kohlmeyer
more complete implementation of fix rigid/omp. tested for molecule type 
Feb 9 2013
1d68769ded88Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Feb 9 2013
2fcebd9548b4Axel Kohlmeyer
partial implementation of multi-threaded rigid integrator. tested. 
Feb 9 2013
60c26a0d6cc6Axel Kohlmeyer
add some more compiler hints 
Feb 9 2013
0ffeedecf033Axel Kohlmeyer
mass conversion of bonded interactions for better compiler optimization 
Feb 8 2013
8c1b86f077daAxel Kohlmeyer
rename vec3_t and vec4_t to dbl3_t and dbl4_t 
Feb 8 2013
9494ea04b619Axel Kohlmeyer
convert many /omp pair styles for better compiler optimization 
Feb 8 2013
fe33ffda9898Axel Kohlmeyer
help the c++ compiler to optimize better trial run on lj/cut/omp 
Feb 8 2013
0a6ec2b279f8Axel Kohlmeyer
add typedef and define for helping the compiler to do better optimization 
Feb 8 2013
01311d340adcsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9408 f3b2605a-c512-4ea7… 
Feb 8 2013
8c101ebc7007sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9407 f3b2605a-c512-4ea7… 
Feb 8 2013
960e79fe53ecsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9406 f3b2605a-c512-4ea7… 
Feb 8 2013
6676724eeebcsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9404 f3b2605a-c512-4ea7… 
Feb 8 2013
c5651e89b5ceAxel Kohlmeyer
let compilers to a better job at optimizating loops over x,y,z atom properties 
Feb 8 2013
e1f19d73d222Axel Kohlmeyer
/omp variant of nve integrator 
Feb 8 2013
af5399b87c0cAxel Kohlmeyer
add missing wrapper class for fix nph/omp 
Feb 8 2013
fe27b7df287cAxel Kohlmeyer
add multi-threaded sphere integrators 
Feb 7 2013
6534e67e3651Axel Kohlmeyer
remove obsolete branch in velocity update code 
Feb 7 2013
9658e11cc343Axel Kohlmeyer
added classes for aspherical nph/npt/nvt integration 
Feb 7 2013
f1ca3540e112Axel Kohlmeyer
start multithreaded integrators for aspherical objects 
Feb 7 2013
e29e0c8ff1d7Axel Kohlmeyer
multi-threaded version of fix nvt/sllod 
Feb 7 2013
e7dc86d2c7b4Axel Kohlmeyer
add threaded version of the last method frequently looping over all atoms 
Feb 7 2013
eb7336217181Axel Kohlmeyer
enable parallel pressure support with bias 
Feb 7 2013
dc4996deee92Axel Kohlmeyer
add one more multithreaded integrator method 
Feb 7 2013
63dc5150312eAxel Kohlmeyer
implement multi-threaded DomainOMP::pbc() method 
Feb 7 2013
a594c8ac12afAxel Kohlmeyer
multi-thread some frequently user functions in Domain 
Feb 7 2013
21adc8e8226eAxel Kohlmeyer
expand OpenMP support in time integration 
Feb 7 2013
3fc2f7c4a9f2Axel Kohlmeyer
fix typo 
Feb 7 2013
46a05e33628dAxel Kohlmeyer
one more stupid bug fixed 
Feb 7 2013
d4af628c7304Axel Kohlmeyer
fix typos 
Feb 7 2013
7a2c634216d0Axel Kohlmeyer
first stab at multi-threading fix nh based integrators 
Feb 6 2013
b01907cd9549Axel Kohlmeyer
more uses of special math functions 
Feb 5 2013
49690af8566dAxel Kohlmeyer
use special math functions 
Feb 4 2013
58d375dda361Axel Kohlmeyer
add OpenMP versions of recently added bonded styles 
Feb 3 2013
225d792ce991Axel Kohlmeyer
make package management scripts more steve-friendly 
Feb 3 2013
d7962731c901Axel Kohlmeyer
make msm/omp compatible with broken OpenMP in gcc 4.2 
Feb 1 2013
0b779e30baa6Axel Kohlmeyer
refactoring of dihedral_style table. 
Feb 1 2013
e040273d4a4fAxel Kohlmeyer
bugfix for hybrid pair styles. 
Jan 29 2013
a4bc5aa73a55sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9312 f3b2605a-c512-4ea7… 
Jan 24 2013
5b1fe9d76389Axel Kohlmeyer
update /omp versions of brownian and lubricate pair styles for changes in… 
Jan 21 2013
56a3ae0ecad6sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9280 f3b2605a-c512-4ea7… 
Jan 17 2013
b078dc5e0bebsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9279 f3b2605a-c512-4ea7… 
Jan 17 2013
d39910bd4cf5Axel Kohlmeyer
fix bug in energy accounting for hybrid pair styles 
Jan 16 2013
5b513be37e3eAxel Kohlmeyer
fix another typo from cut-n-paste 
Jan 15 2013
8ddab3b7db97Axel Kohlmeyer
fix typo 
Jan 15 2013
afaae2555570Axel Kohlmeyer
flatten outer loop and use more specific template arguments 
Jan 15 2013
be809bbd2116Axel Kohlmeyer
turn all evflag components into template parameters 
Jan 14 2013
26877613a9dfAxel Kohlmeyer
we need to provide MSMOMP::compute() as well, to call reduce_thr(). 
Jan 14 2013
d81a3671db8bAxel Kohlmeyer
small serial optimizations 
Jan 14 2013
bb65b1c96d12Axel Kohlmeyer
added msm/omp style 
Jan 14 2013
f9d7ef4d38caAxel Kohlmeyer
add /omp versions of MSM compatible pair styles 
Jan 14 2013
427161ef56aaAxel Kohlmeyer
Merge branch 'master' into lammps-icms 
Jan 9 2013
c3ed94c40c1asjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9193 f3b2605a-c512-4ea7… 
Jan 2 2013
6dcb5fb23d35sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9002 f3b2605a-c512-4ea7… 
Oct 25 2012
dc90a512268cAxel Kohlmeyer
remove support for kspace proxy styles 
Oct 22 2012
23d0292fe4beAxel Kohlmeyer
adjust for name change in tip4p styles and removal of proxy styles 
Oct 22 2012
ce7ea4907908Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Oct 22 2012
f97c62c76ec6sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8975 f3b2605a-c512-4ea7… 
Oct 19 2012
9a0e9670fb05Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Oct 12 2012
56887bc96f2fsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8893 f3b2605a-c512-4ea7… 
Oct 3 2012
192ba5588f91sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8892 f3b2605a-c512-4ea7… 
Oct 3 2012
7eb3ccf732eesjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8891 f3b2605a-c512-4ea7… 
Oct 3 2012
6486693ef3b6sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8885 f3b2605a-c512-4ea7… 
Oct 3 2012
f5d2d8b1e8b7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8884 f3b2605a-c512-4ea7… 
Oct 3 2012
3af0a1fa598esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8872 f3b2605a-c512-4ea7… 
Oct 3 2012
f3bbe8b36944sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8871 f3b2605a-c512-4ea7… 
Oct 3 2012
53b3866b3df4sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8870 f3b2605a-c512-4ea7… 
Oct 3 2012
1adc4fee9892sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8869 f3b2605a-c512-4ea7… 
Oct 2 2012
06e67b08dfe6sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8868 f3b2605a-c512-4ea7… 
Oct 2 2012
27809e8a2441sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8865 f3b2605a-c512-4ea7… 
Oct 2 2012
9a9291036d88sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7… 
Oct 2 2012
fb6436ab4ea7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8863 f3b2605a-c512-4ea7… 
Oct 2 2012
e0540b5c2b4esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8862 f3b2605a-c512-4ea7… 
Oct 2 2012
88af162c7c45sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8861 f3b2605a-c512-4ea7… 
Oct 2 2012
ccda8dd203a4sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8860 f3b2605a-c512-4ea7… 
Oct 2 2012
e706cea89765sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8807 f3b2605a-c512-4ea7… 
Sep 20 2012
a5d7cc647231Axel Kohlmeyer
incorporate change from upstream 
Sep 19 2012
c3629d841da6Axel Kohlmeyer
add mutual support for verlet/split with OpenMP 
Sep 4 2012
d974674bc5f5sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8714 f3b2605a-c512-4ea7… 
Aug 27 2012
b3575fda8ce0Axel Kohlmeyer
make granular OpenMP pair styles compatible with upstream 
Aug 25 2012
788b01cd7186Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Aug 18 2012
d29dd35c4554sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8678 f3b2605a-c512-4ea7… 
Aug 17 2012
f73d1bffe299Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Jul 26 2012
47552d40335esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8498 f3b2605a-c512-4ea7… 
Jul 25 2012
5e52200ad3a8sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8496 f3b2605a-c512-4ea7… 
Jul 25 2012
c3774f876b1cAxel Kohlmeyer
workaround for upcoming pppm changes. 
Jul 6 2012
8be34761c8cbAxel Kohlmeyer
include bugfix from tom coles. 
Jul 3 2012
2a099bfedb48Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Jun 30 2012
945fc5a36a65sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8434 f3b2605a-c512-4ea7… 
Jun 29 2012
e8ff810ee770sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8391 f3b2605a-c512-4ea7… 
Jun 25 2012
First
Prev
2
3
4
5
6
Next
c4science · Help