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Merge branch release-5-1 into release-2016
[alexxy/gromacs.git]
/
src
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gromacs
/
mdlib
/
forcerec.cpp
2016-06-08
Mark Abraham
Merge branch release-5-1 into release-2016
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2016-05-27
Mark Abraham
Fix reading of bonded tables
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2016-05-12
Mark Abraham
Merge branch release-5-1 into release-2016
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2016-05-05
Teemu Murtola
Merge branch release-5-1
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2016-04-27
Mark Abraham
Merge branch release-5-1
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2016-04-27
Teemu Murtola
Merge "Merge branch release-5-1"
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2016-04-19
Szilárd Páll
Move out CUDA profiler triggers from NBNXN
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2016-04-19
Berk Hess
Allow rcoulomb>rvdw with PME
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2016-04-14
Mark Abraham
Merge branch release-5-1
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2016-03-31
Szilárd Páll
Fix multiple tMPI ranks per OpenCL device
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2016-03-22
Berk Hess
LJ combination rule kernels for CUDA
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2016-03-15
Mark Abraham
Merge branch release-5-0 into release-5-1
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2016-03-11
Mark Abraham
Merge branch release-5-0 into release-5-1
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2016-02-21
Mark Abraham
Separate table construction
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2016-02-19
Gerrit Code Review
Merge "Merge branch release-5-1"
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2016-02-19
Mark Abraham
Merge branch release-5-1
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2016-02-16
Mark Abraham
Merge branch release-5-0 into release-5-1
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2016-02-15
Szilárd Páll
Allow GMX_NB_MIN_CI=0 to be passed
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2016-02-11
Szilárd Páll
Re-enable LJ-PME + Lorentz-Berthelot on GPUs
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2016-02-08
Mark Abraham
Merge branch release-5-0 into release-5-1
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2016-02-06
Mark Abraham
Merge branch release-5-1
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2016-02-03
Mark Abraham
Merge release-5-0 into release-5-1
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2016-01-28
Mark Abraham
Merge branch release-5-1
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2016-01-27
Mark Abraham
Merge branch release-5-1
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2016-01-25
Mark Abraham
Merge branch release-5-1
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2016-01-20
Szilárd Páll
Merge remote-tracking branch 'origin/release-5-1' into...
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2016-01-12
Mark Abraham
Merge branch release-5-0 into release-5-1
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2016-01-11
Teemu Murtola
Convert more config.h defines to 0/1
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2016-01-08
Mark Abraham
Merge branch release-5-1
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2016-01-07
Mark Abraham
Fix some mdrun header dependencies
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2016-01-04
Mark Abraham
Change GMX_DOUBLE to be always defined
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2015-12-28
Mark Abraham
Merge branch release-5-1
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2015-12-20
Berk Hess
Merge release-5-1 into master
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2015-12-17
Mark Abraham
Simplified energy-summation code
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2015-12-16
Erik Lindahl
Next-generation SIMD module, reference implementation
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2015-12-15
Erik Lindahl
C++ math function cleanup
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2015-12-15
Teemu Murtola
Move main.*, splitter.*, gmx_omp_nthreads.* to mdlib
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2015-12-15
Teemu Murtola
Move hardware detection to hardware/
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2015-12-15
Teemu Murtola
Move gpu_utils etc. out of gmxlib
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2015-12-12
Teemu Murtola
Create separate module for trajectory data
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2015-12-12
Mark Abraham
Broke up copyright.*
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2015-12-11
Teemu Murtola
Merge "Merge branch 'origin/release-5-1'"
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2015-12-10
Mark Abraham
Merge branch 'origin/release-5-1'
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2015-12-09
Teemu Murtola
Split txtdump.*, part 1
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2015-12-08
Mark Abraham
Merge branch 'release-5-0' into release-5-1
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2015-12-02
Teemu Murtola
Split filenm.*
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2015-12-02
Mark Abraham
Remove twin-range scheme
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2015-11-30
Teemu Murtola
Merge remaining legacyheaders/types/ to mdtypes/
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2015-11-23
David van der Spoel
Moved domdec structures out of commrec.h.
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2015-11-22
Teemu Murtola
Remove correlationfunctions -> mdtypes dependency
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2015-11-20
David van der Spoel
Moved legacyheaders/types/group.h to mdtypes.
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2015-11-20
David van der Spoel
Merged legacyheaders/types/ns.h and nblist.h to mdtypes...
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2015-11-20
David van der Spoel
Combine enums.h and names*.
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2015-11-18
Berk Hess
Removed Reaction-Field-nec
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2015-11-16
Mark Abraham
Merge branch release-5-1
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2015-11-15
Mark Abraham
Remove AdResS
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2015-11-14
Teemu Murtola
Move network.h to gmxlib/
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2015-11-13
Teemu Murtola
Move gmx_detect_hardware.h to gmxlib/
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2015-11-13
Teemu Murtola
Move nonbonded.h to gmxlib/nonbonded/
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2015-11-12
David van der Spoel
Moved txtdump.* to fileio.
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2015-11-12
David van der Spoel
Moved copyrite.* to fileio from gmxlib and legacyheaders.
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2015-11-11
David van der Spoel
Moved inputrec.* from gmxlib and legacyheaders to mdtypes.
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2015-11-11
Mark Abraham
Merge release-5-0 into release-5-1
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2015-11-10
David van der Spoel
Removed legacyheaders/typedefs.h
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2015-11-07
Teemu Murtola
Move gmx_omp_nthreads.h and gmx_thread_affinity.h to...
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2015-11-06
Teemu Murtola
Move ns.h and nsgrid.h to mdlib/
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2015-11-06
Teemu Murtola
Move force.h and vsite.h into mdlib/
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2015-11-04
Mark Abraham
Merge branch release-5-1
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2015-11-03
Mark Abraham
Merge branch release-5-1
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2015-11-02
Erik Lindahl
Moved GMX_SIMD_* macros from ifdefs to values 0/1
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2015-10-14
Mark Abraham
Merge release-5-0 into release-5-1
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2015-10-13
Erik Lindahl
Replace GROMACS-specific math functions with C++11...
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2015-10-07
Mark Abraham
Merge branch release-5-1 into master
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2015-10-05
Mark Abraham
Merge release-5-0 into release-5-1
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diff to current
2015-10-05
Mark Abraham
Merge "Merge branch release-5-1 into master"
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2015-10-03
Teemu Murtola
Merge branch release-5-1 into master
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2015-10-03
Mark Abraham
Fix mdrun -nb auto -rerun with GPU and energy groups
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2015-10-01
Berk Hess
Removed CUDA polling wait
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2015-09-29
Mark Abraham
Clean up of tables code
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2015-09-29
Mark Abraham
Move tables.c to new module and C++
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2015-09-27
Teemu Murtola
More headers out of legacyheaders
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2015-09-25
David van der Spoel
Removed include of types/ifunc.h from typedefs.h
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2015-09-22
David van der Spoel
Removed four includes from legacyheaders/typedefs.h
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2015-09-18
Teemu Murtola
Move asize() from macros.h and reduce use of macros.h
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2015-09-16
Berk Hess
Split nbnxn_grid.c off from nbnxn_search.c
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2015-09-15
Mark Abraham
Merge branch release-5-1
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2015-09-09
David van der Spoel
Removed fileio/trx.h from typedefs.h
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2015-09-08
David van der Spoel
Moved functions operating on forcerec to separate header.
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2015-08-14
Mark Abraham
Merge branch release-5-1 into master
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diff to current
2015-08-08
Mark Abraham
Merge branch release-5-0 into release-5-1
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2015-08-04
Mark Abraham
Merge release-5-0 into release-5-1
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2015-07-26
Erik Lindahl
Merge branch release-5-1
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2015-07-26
Mark Abraham
Merge branch release-5-0 into release-5-1
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2015-07-24
Mark Abraham
Merge branch release-5-1
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2015-07-20
Teemu Murtola
Merge release-5-0 into release-5-1
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diff to current
2015-07-08
Roland Schulz
Merge release-5-1 into master
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diff to current
2015-07-08
Roland Schulz
Merge release-5-0 into release-5-1
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diff to current
2015-07-08
Berk Hess
Separated bonded and Ewald correction threading
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2015-07-02
Teemu Murtola
Clean up gmxfio includes
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2015-06-29
Mark Abraham
Merge branch release-5-0
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biod.pnpi.spb.ru / alexxy / gromacs.git / history