biod.pnpi.spb.ru
/
alexxy
/
gromacs.git
/ history
commit
grep
author
committer
pickaxe
?
search:
re
summary
|
shortlog
|
log
|
commit
|
commitdiff
|
tree
first ⋅ prev ⋅ next
Extract helper force buffers to a separate class
[alexxy/gromacs.git]
/
src
/
gromacs
/
domdec
/
partition.cpp
2020-05-12
Berk Hess
Extract helper force buffers to a separate class
blob
|
commitdiff
|
raw
2020-05-12
Berk Hess
Refactor virtual site interface
blob
|
commitdiff
|
raw
|
diff to current
2020-05-06
Paul Bauer
Merge branch 'origin/release-2020' into master
blob
|
commitdiff
|
raw
|
diff to current
2020-04-06
Berk Hess
Move force buffer resizing to mdsetup
blob
|
commitdiff
|
raw
|
diff to current
2020-03-18
Berk Hess
Remove use of graph in do_force()
blob
|
commitdiff
|
raw
|
diff to current
2020-03-04
Paul Bauer
Merge branch release-2020 into master
blob
|
commitdiff
|
raw
|
diff to current
2020-02-28
Paul Bauer
Merge branch release-2019 into release-2020
blob
|
commitdiff
|
raw
|
diff to current
2020-02-24
Pascal Merz
Use ArrayRef in compute_globals
blob
|
commitdiff
|
raw
|
diff to current
2020-02-23
ejjordan
Use more forward declarations to removed header depende...
blob
|
commitdiff
|
raw
|
diff to current
2020-01-28
Paul Bauer
Merge branch origin/release-2020 into master
blob
|
commitdiff
|
raw
|
diff to current
2020-01-09
Mark Abraham
Clean up ewald module internals
blob
|
commitdiff
|
raw
|
diff to current
2020-01-08
Roland Schulz
Merge release-2019 into release-2020
blob
|
commitdiff
|
raw
|
diff to current
2020-01-07
Paul Bauer
Merge branch origin/release-2020 into master
blob
|
commitdiff
|
raw
|
diff to current
2020-01-07
Paul Bauer
Merge commit d30f2cb6 from release-2020 into master
blob
|
commitdiff
|
raw
|
diff to current
2019-12-27
Paul Bauer
Merge origin/release-2019 into release-2020
blob
|
commitdiff
|
raw
|
diff to current
2019-12-19
ejjordan
Change some domdec data members to RVec or IVec
blob
|
commitdiff
|
raw
|
diff to current
2019-12-12
Paul Bauer
Merge branch 'origin/release-2020' into master
blob
|
commitdiff
|
raw
|
diff to current
2019-11-30
Paul Bauer
Merge origin/release-2020 into master
blob
|
commitdiff
|
raw
|
diff to current
2019-11-29
Mark Abraham
Merge branch release-2019 into release-2020
blob
|
commitdiff
|
raw
|
diff to current
2019-11-21
Mark Abraham
Merge branch release-2020
blob
|
commitdiff
|
raw
|
diff to current
2019-11-20
Paul Bauer
Merge 'origin/release-2019' into release-2020
blob
|
commitdiff
|
raw
|
diff to current
2019-11-19
Berk Hess
Fix bonded atom communication performance
blob
|
commitdiff
|
raw
|
diff to current
2019-11-14
Berk Hess
Simplify t_forcerec destruction
blob
|
commitdiff
|
raw
|
diff to current
2019-11-07
Paul Bauer
Apply clang-format to source tree
blob
|
commitdiff
|
raw
|
diff to current
2019-10-29
Paul Bauer
Merge branch 'release-2019' into master
blob
|
commitdiff
|
raw
|
diff to current
2019-10-23
Berk Hess
Use gmx::Range in Nbnxm gridding functions
blob
|
commitdiff
|
raw
|
diff to current
2019-10-01
Berk Hess
Use gmx::Range in domdec
blob
|
commitdiff
|
raw
|
diff to current
2019-10-01
Berk Hess
Completely remove charge groups
blob
|
commitdiff
|
raw
|
diff to current
2019-10-01
Berk Hess
Simplify DD exclusion counting
blob
|
commitdiff
|
raw
|
diff to current
2019-09-30
Berk Hess
Remove charge group code from forcerec
blob
|
commitdiff
|
raw
|
diff to current
2019-09-25
Szilárd Páll
Merge remote-tracking branch 'origin/release-2019'
blob
|
commitdiff
|
raw
|
diff to current
2019-09-24
Mark Abraham
Merge "Merge branch release-2019 into master"
blob
|
commitdiff
|
raw
|
diff to current
2019-09-24
Paul Bauer
Merge branch release-2019 into master
blob
|
commitdiff
|
raw
|
diff to current
2019-09-24
Berk Hess
Remove obsolete dd_get_ns_ranges()
blob
|
commitdiff
|
raw
|
diff to current
2019-09-19
Berk Hess
Remove bLocalCG from DD code
blob
|
commitdiff
|
raw
|
diff to current
2019-09-12
Artem Zhmurov
Change PaddedVector to PaddedHostVector for force CPU...
blob
|
commitdiff
|
raw
|
diff to current
2019-09-09
Berk Hess
Clean up PME rank variables
blob
|
commitdiff
|
raw
|
diff to current
2019-09-05
Berk Hess
Extract DDRankSetup from gmx_domdec_comm_t
blob
|
commitdiff
|
raw
|
diff to current
2019-09-04
Berk Hess
Collect settings for DD in DDSettings
blob
|
commitdiff
|
raw
|
diff to current
2019-09-04
Berk Hess
Move constraint and bonded filtering info into DDSystemInfo
blob
|
commitdiff
|
raw
|
diff to current
2019-09-04
Berk Hess
Move update grouping to DDSystemInfo
blob
|
commitdiff
|
raw
|
diff to current
2019-09-03
Berk Hess
Extract DDSystemInfo from gmx_domdec_comm_t
blob
|
commitdiff
|
raw
|
diff to current
2019-09-03
Berk Hess
Extact UnitCellInfo from gmx_domdec_t
blob
|
commitdiff
|
raw
|
diff to current
2019-08-22
Mark Abraham
Merge branch release-2019
blob
|
commitdiff
|
raw
|
diff to current
2019-08-20
Mark Abraham
Apply clang-tidy-8 readability-uppercase-literal-suffix
blob
|
commitdiff
|
raw
|
diff to current
2019-08-20
Mark Abraham
Fix issues for clang-analyzer-8
blob
|
commitdiff
|
raw
|
diff to current
2019-08-01
Mark Abraham
Manage compiler flags and some include options per...
blob
|
commitdiff
|
raw
|
diff to current
2019-08-01
Paul Bauer
Merge release-2019 into master
blob
|
commitdiff
|
raw
|
diff to current
2019-07-11
Pascal Merz
Remove dependence of compute_globals on t_state
blob
|
commitdiff
|
raw
|
diff to current
2019-06-14
Paul Bauer
Merge branch release-2018 into release-2019
blob
|
commitdiff
|
raw
|
diff to current
2019-04-18
Berk Hess
Remove charge groups from domdec and localtop
blob
|
commitdiff
|
raw
|
diff to current
2019-04-18
Mark Abraham
Move pull work struct out of inputrec
blob
|
commitdiff
|
raw
|
diff to current
2019-04-17
Berk Hess
Remove group scheme search code
blob
|
commitdiff
|
raw
|
diff to current
2019-04-17
Berk Hess
Simplify vsite PBC handling
blob
|
commitdiff
|
raw
|
diff to current
2019-04-17
Prashanth Kanduri
Move shellfc code to the mdrun module
blob
|
commitdiff
|
raw
|
diff to current
2019-04-16
Mark Abraham
Removed mdrun -gcom
blob
|
commitdiff
|
raw
|
diff to current
2019-04-10
Mark Abraham
Make ImdSession into a Pimpl-ed class with factory...
blob
|
commitdiff
|
raw
|
diff to current
2019-04-10
Mark Abraham
Reform IMD module
blob
|
commitdiff
|
raw
|
diff to current
2019-03-15
Berk Hess
Change nbnxn_search to class PairSearch
blob
|
commitdiff
|
raw
|
diff to current
2019-03-14
Berk Hess
Add nbnxm GridSet class
blob
|
commitdiff
|
raw
|
diff to current
2019-03-02
Mark Abraham
Merge branch release-2019
blob
|
commitdiff
|
raw
|
diff to current
2019-02-28
Berk Hess
Use unique_ptr in nonbonded_verlet_t
blob
|
commitdiff
|
raw
|
diff to current
2019-02-21
Berk Hess
Simplify make_pairlist() call signature
blob
|
commitdiff
|
raw
|
diff to current
2019-02-20
Paul Bauer
Merge "Merge branch 'release-2019' into master"
blob
|
commitdiff
|
raw
|
diff to current
2019-02-20
Paul Bauer
Merge branch 'release-2019' into master
blob
|
commitdiff
|
raw
|
diff to current
2019-02-17
Berk Hess
Use enum class for nbnxm locality
blob
|
commitdiff
|
raw
|
diff to current
2019-02-16
Berk Hess
Move nbnxn files to nbnxm directory
blob
|
commitdiff
|
raw
|
diff to current
2019-02-07
Roland Schulz
Revert size to be unsigned for ArrayRef
blob
|
commitdiff
|
raw
|
diff to current
2019-02-07
Roland Schulz
Add ssize and remove static_casts
blob
|
commitdiff
|
raw
|
diff to current
2019-02-06
Berk Hess
Fix segfault with EM, DD and group scheme
blob
|
commitdiff
|
raw
|
diff to current
2019-01-30
Mark Abraham
Merge remote branch release-2018 into release-2019
blob
|
commitdiff
|
raw
|
diff to current
2019-01-23
Roland Schulz
Merge release-2019 into master
blob
|
commitdiff
|
raw
|
diff to current
2019-01-23
Roland Schulz
Merge release-2018 into release-2019
blob
|
commitdiff
|
raw
|
diff to current
2019-01-04
Paul Bauer
Change gmx_localtop_t to C++
blob
|
commitdiff
|
raw
|
diff to current
2019-01-03
Berk Hess
Fix segmentation fault in DD code
blob
|
commitdiff
|
raw
|
diff to current
2018-12-31
Paul Bauer
Merge branch release-2018 into release-2019
blob
|
commitdiff
|
raw
|
diff to current
2018-12-19
Paul Bauer
Merge "Merge release-2019 branch into master"
blob
|
commitdiff
|
raw
|
diff to current
2018-12-18
Szilárd Páll
Merge release-2019 branch into master
blob
|
commitdiff
|
raw
|
diff to current
2018-12-17
Paul Bauer
Merge branch release-2018 into release-2019
blob
|
commitdiff
|
raw
|
diff to current
2018-12-12
Szilárd Páll
Improve DLB report/note
blob
|
commitdiff
|
raw
|
diff to current
2018-11-21
Paul Bauer
Merge branch release-2018 into release-2019
blob
|
commitdiff
|
raw
|
diff to current
2018-11-20
Mark Abraham
Merge "Merge release-2019 into master"
blob
|
commitdiff
|
raw
|
diff to current
2018-11-16
Roland Schulz
Merge release-2019 into master
blob
|
commitdiff
|
raw
|
diff to current
2018-11-08
Berk Hess
Fix bug with DD for dims without PBC
blob
|
commitdiff
|
raw
|
diff to current
2018-10-26
Mark Abraham
Merge branch release-2018 into release-2019
blob
|
commitdiff
|
raw
|
diff to current
2018-10-08
Berk Hess
Enable update groups
blob
|
commitdiff
|
raw
|
diff to current
2018-10-08
Mark Abraham
Implement PaddedVector
blob
|
commitdiff
|
raw
|
diff to current
2018-10-02
Berk Hess
Update DD cutoffs for update groups
blob
|
commitdiff
|
raw
|
diff to current
2018-09-29
Berk Hess
Add UpdateGroupsCog to DD
blob
|
commitdiff
|
raw
|
diff to current
2018-09-26
Pascal Merz
(Re-)fix typo in DD load balancing printing
blob
|
commitdiff
|
raw
|
diff to current
2018-09-22
Berk Hess
Rename DD constraint booleans
blob
|
commitdiff
|
raw
|
diff to current
2018-09-20
Berk Hess
Fix type bug in trilinic DD code
blob
|
commitdiff
|
raw
|
diff to current
2018-09-18
Mark Abraham
Separated partitioning and dlb code within domdec
blob
|
commitdiff
|
raw
|
diff to current
biod.pnpi.spb.ru / alexxy / gromacs.git / history