biod.pnpi.spb.ru
/
alexxy
/
gromacs.git
/ history
commit
grep
author
committer
pickaxe
?
search:
re
summary
|
shortlog
|
log
|
commit
|
commitdiff
|
tree
first ⋅ prev ⋅
next
Remove support for implicit solvation
[alexxy/gromacs.git]
/
src
/
gromacs
/
mdlib
/
force.cpp
2018-01-23
Mark Abraham
Remove support for implicit solvation
blob
|
commitdiff
|
raw
2018-01-09
Mark Abraham
Merge branch release-2016 into release-2018
blob
|
commitdiff
|
raw
|
diff to current
2017-12-22
Mark Abraham
Merge branch release-2016 into release-2018
blob
|
commitdiff
|
raw
|
diff to current
2017-12-21
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-12-20
Mark Abraham
Merge branch release-2016 into release-2018
blob
|
commitdiff
|
raw
|
diff to current
2017-12-12
Mark Abraham
Merge branch release-2016 into release-2018
blob
|
commitdiff
|
raw
|
diff to current
2017-12-04
Mark Abraham
Merge branch release-2016 into release-2018
blob
|
commitdiff
|
raw
|
diff to current
2017-11-03
Mark Abraham
Merge "Merge branch release-2016"
blob
|
commitdiff
|
raw
|
diff to current
2017-11-02
Aleksei Iupinov
Replace math.h by cmath includes in cpp files
blob
|
commitdiff
|
raw
|
diff to current
2017-11-02
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-10-24
Aleksei Iupinov
Move commrec duty checking into simple getters
blob
|
commitdiff
|
raw
|
diff to current
2017-10-21
Berk Hess
Merge "Merge branch release-2016"
blob
|
commitdiff
|
raw
|
diff to current
2017-10-21
Aleksei Iupinov
Add calls to the PME GPU stages
blob
|
commitdiff
|
raw
|
diff to current
2017-10-20
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-10-16
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-10-13
Roland Schulz
Replace all ConstArrayRef with ArrayRef<const T>
blob
|
commitdiff
|
raw
|
diff to current
2017-10-12
Berk Hess
Simplify virial handling
blob
|
commitdiff
|
raw
|
diff to current
2017-10-05
Szilárd Páll
Refactor scaled box handling for PME/Ewald
blob
|
commitdiff
|
raw
|
diff to current
2017-09-28
tomaskubar
QM/MM: remove optimization and trans. state search
blob
|
commitdiff
|
raw
|
diff to current
2017-09-17
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-09-15
Berk Hess
Remove nb-parameters from t_forcerec
blob
|
commitdiff
|
raw
|
diff to current
2017-09-12
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-09-12
Szilárd Páll
Merge branch 'release-2016'
blob
|
commitdiff
|
raw
|
diff to current
2017-09-03
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-08-22
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-08-15
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-07-09
Berk Hess
Restructure the load balancing timing
blob
|
commitdiff
|
raw
|
diff to current
2017-06-28
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-06-27
Roland Schulz
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-05-09
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-03-31
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-03-14
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-02-15
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-02-07
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-02-05
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-01-31
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-01-21
Mark Abraham
Removed init_state
blob
|
commitdiff
|
raw
|
diff to current
2017-01-14
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2017-01-11
Roland Schulz
Tidy: modernize-use-nullptr
blob
|
commitdiff
|
raw
|
diff to current
2017-01-03
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-12-20
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-12-12
Teemu Murtola
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-12-07
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-10-31
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-10-31
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-10-09
Mark Abraham
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-10-07
Berk Hess
Changed fr->f_novirsum to PaddedRVecVector
blob
|
commitdiff
|
raw
|
diff to current
2016-10-03
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-09-29
Berk Hess
Use std::vector in t_state
blob
|
commitdiff
|
raw
|
diff to current
2016-09-16
Berk Hess
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-09-16
Berk Hess
Made distance restraints work with threads and DD
blob
|
commitdiff
|
raw
|
diff to current
2016-09-15
Aleksei Iupinov
Move the PME Ewald coefficients to the PME structure
blob
|
commitdiff
|
raw
|
diff to current
2016-09-08
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-09-05
David van der Spoel
Merge "Merge branch release-2016"
blob
|
commitdiff
|
raw
|
diff to current
2016-09-04
Berk Hess
Merge branch release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-09-03
Berk Hess
Clean up PME flags variable use
blob
|
commitdiff
|
raw
|
diff to current
2016-09-02
Berk Hess
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-08-24
Berk Hess
Fix Ewald surface+3DC corrections
blob
|
commitdiff
|
raw
|
diff to current
2016-08-24
Berk Hess
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-07-29
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-07-08
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-06-30
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-06-27
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-06-22
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-06-17
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-06-08
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-05-12
Mark Abraham
Merge branch release-5-1 into release-2016
blob
|
commitdiff
|
raw
|
diff to current
2016-05-05
Teemu Murtola
Merge branch release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2016-04-27
Mark Abraham
Merge branch release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2016-04-14
Mark Abraham
Merge branch release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2016-03-15
Mark Abraham
Merge branch release-5-0 into release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2016-03-11
Mark Abraham
Merge branch release-5-0 into release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2016-02-19
Mark Abraham
Merge branch release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2016-02-16
Mark Abraham
Merge branch release-5-0 into release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2016-02-08
Mark Abraham
Merge branch release-5-0 into release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2016-02-06
Mark Abraham
Merge branch release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2016-02-03
Mark Abraham
Merge release-5-0 into release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2016-01-28
Mark Abraham
Merge branch release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2016-01-27
Mark Abraham
Merge branch release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2016-01-25
Mark Abraham
Merge branch release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2016-01-20
Szilárd Páll
Merge remote-tracking branch 'origin/release-5-1' into...
blob
|
commitdiff
|
raw
|
diff to current
2016-01-12
Mark Abraham
Merge branch release-5-0 into release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2016-01-12
Teemu Murtola
Make GMX_MPI always defined to 0/1
blob
|
commitdiff
|
raw
|
diff to current
2016-01-08
Mark Abraham
Merge branch release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2015-12-29
Teemu Murtola
Reduce inputrec.h dependencies
blob
|
commitdiff
|
raw
|
diff to current
2015-12-28
Mark Abraham
Merge branch release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2015-12-20
Berk Hess
Merge release-5-1 into master
blob
|
commitdiff
|
raw
|
diff to current
2015-12-15
Teemu Murtola
Move main.*, splitter.*, gmx_omp_nthreads.* to mdlib
blob
|
commitdiff
|
raw
|
diff to current
2015-12-11
Teemu Murtola
Merge "Merge branch 'origin/release-5-1'"
blob
|
commitdiff
|
raw
|
diff to current
2015-12-10
Mark Abraham
Merge branch 'origin/release-5-1'
blob
|
commitdiff
|
raw
|
diff to current
2015-12-09
Teemu Murtola
Split txtdump.*, part 2
blob
|
commitdiff
|
raw
|
diff to current
2015-12-08
Mark Abraham
Merge branch 'release-5-0' into release-5-1
blob
|
commitdiff
|
raw
|
diff to current
2015-12-02
Mark Abraham
Remove twin-range scheme
blob
|
commitdiff
|
raw
|
diff to current
2015-11-30
Teemu Murtola
Merge remaining legacyheaders/types/ to mdtypes/
blob
|
commitdiff
|
raw
|
diff to current
2015-11-23
David van der Spoel
Moved domdec structures out of commrec.h.
blob
|
commitdiff
|
raw
|
diff to current
2015-11-20
David van der Spoel
Merged legacyheaders/types/ns.h and nblist.h to mdtypes...
blob
|
commitdiff
|
raw
|
diff to current
2015-11-20
David van der Spoel
Combine enums.h and names*.
blob
|
commitdiff
|
raw
|
diff to current
2015-11-20
David van der Spoel
Merged legacyheaders/nrnb.h and types/nrnb.h to gmxlib.
blob
|
commitdiff
|
raw
|
diff to current
2015-11-18
Berk Hess
Removed Reaction-Field-nec
blob
|
commitdiff
|
raw
|
diff to current
2015-11-16
Mark Abraham
Merge branch release-5-1
blob
|
commitdiff
|
raw
|
diff to current
next