biod.pnpi.spb.ru
/
alexxy
/
gromacs.git
/ history
commit
grep
author
committer
pickaxe
?
search:
re
summary
|
shortlog
|
log
|
commit
|
commitdiff
|
tree
first ⋅ prev ⋅
next
Added two missing headers
[alexxy/gromacs.git]
/
include
/
2011-07-11
Carsten Kutzner
Added two missing headers
tree
|
commitdiff
2011-07-06
Carsten Kutzner
Added globsig.h to include/types/Makefile.am
tree
|
commitdiff
2011-07-01
David van der Spoel
Merge branch 'release-4-5-patches' of git@git.gromacs...
tree
|
commitdiff
2011-06-10
David van der Spoel
Merge branch 'release-4-5-patches' of git@git.gromacs...
tree
|
commitdiff
2011-06-08
Sander Pronk
Added support for SunCC on Solaris/SPARC.
tree
|
commitdiff
2011-05-31
David van der Spoel
Merge branch 'release-4-5-patches' of git@git.gromacs...
tree
|
commitdiff
2011-05-23
David van der Spoel
Merge branch 'release-4-5-patches' of git@git.gromacs...
tree
|
commitdiff
2011-05-06
David van der Spoel
Merge branch 'release-4-5-patches' of git@git.gromacs...
tree
|
commitdiff
2011-05-05
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
|
commitdiff
2011-04-21
Erik Marklund
Merge branch 'release-4-5-patches' of git@git.gromacs...
tree
|
commitdiff
2011-04-21
Sander Pronk
Added prototypes for functions in md_support.c to mdrun.h
tree
|
commitdiff
2011-04-21
David van der Spoel
First version of a Density of States analysis tool.
tree
|
commitdiff
2011-04-20
Sander Pronk
Revert "NUMA aware memory allocators get called (for...
tree
|
commitdiff
2011-04-20
Sander Pronk
NUMA aware memory allocators get called (for Windows).
tree
|
commitdiff
2011-04-20
Sander Pronk
New thread_mpi library, with NUMA aware allocator for...
tree
|
commitdiff
2011-04-14
Mark Abraham
Moved various support functions for do_md into mdlib
tree
|
commitdiff
2011-04-14
Mark Abraham
Moved iterated-constraints code into mdlib
tree
|
commitdiff
2011-04-14
Mark Abraham
Moved heuristic neighbor-list code into mdlib
tree
|
commitdiff
2011-04-14
Mark Abraham
Fixed code duplication
tree
|
commitdiff
2011-04-14
Mark Abraham
Fixed header #ifndef test
tree
|
commitdiff
2011-04-11
Justin A. Lemkul
Made g_protonate (partially) work.
tree
|
commitdiff
2011-04-06
David van der Spoel
Fixed header for gmx_conect_init
tree
|
commitdiff
2011-04-04
David van der Spoel
Merge branch 'release-4-5-patches' of git@git.gromacs...
tree
|
commitdiff
2011-04-04
David van der Spoel
Made new programs compile with gcc -pedantic.
tree
|
commitdiff
2011-04-04
David van der Spoel
Merge branch 'release-4-5-patches' into orderparm
tree
|
commitdiff
2011-03-30
Mark Abraham
Suppressed Cygwin C-only compiler warnings
tree
|
commitdiff
2011-03-16
Sander Pronk
mdrun -multi, multidir and replica exchange now exchang...
tree
|
commitdiff
2011-03-10
Sander Pronk
Added more support for multidir.
tree
|
commitdiff
2011-02-11
Mark Abraham
Removed ancient CVS tag lines
tree
|
commitdiff
2011-02-04
Roland Schulz
using set_mm_ps to make pgi happy
tree
|
commitdiff
2011-01-30
David van der Spoel
Merge branch 'release-4-5-patches' into orderparm
tree
|
commitdiff
2011-01-29
David van der Spoel
Merge branch 'release-4-5-patches' of git@git.gromacs...
tree
|
commitdiff
2011-01-28
Mark Abraham
Turned g_options into a normal GROMACS tool
tree
|
commitdiff
2011-01-26
David van der Spoel
Merge branch 'release-4-5-patches' of git@git.gromacs...
tree
|
commitdiff
2011-01-25
Mark Abraham
Relocated some t_matrix documentation
tree
|
commitdiff
2010-11-19
Sander Pronk
Fixed TMPI_WAIT_FOR_NO_ONE deadlock.
tree
|
commitdiff
2010-11-02
Berk Hess
proper defined of MAX_CHARGEGROUP_SIZE=32 in a single...
tree
|
commitdiff
2010-11-02
hess
fixed incorrect y result in mvmul_ur0, only used in...
tree
|
commitdiff
2010-10-30
Sander Pronk
Added Windows macro for snprintf.
tree
|
commitdiff
2010-10-28
David van der Spoel
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
|
commitdiff
2010-10-28
Berk Hess
fixed pdb2gmx chain merging bug (bugzilla 544)
tree
|
commitdiff
2010-10-19
Per Larsson
Replaced _mm_castsi128_pd with gmx_mm_castsi128_pd...
tree
|
commitdiff
2010-10-18
Teemu Murtola
Use CMake install for install-mdrun (bugs #549, #555)
tree
|
commitdiff
2010-10-11
Roland Schulz
fixed spelling
tree
|
commitdiff
2010-10-09
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
|
commitdiff
2010-10-08
Berk Hess
fixed combination of tpic with pme, pme mesh energy...
tree
|
commitdiff
2010-09-23
Mark Abraham
Fixes for g_chi for bugzilla 569, so that it now uses...
tree
|
commitdiff
2010-09-23
Mark Abraham
Extensions to the gmx_residuetypes_t API to meet the...
tree
|
commitdiff
2010-09-20
Per Larsson
Changes to GB non-polar solvation calculations
tree
|
commitdiff
2010-09-17
Sander Pronk
Checkpoints backward-compatible + more consistency...
tree
|
commitdiff
2010-09-16
David van der Spoel
Corrected name of one of the developers listed in header.
tree
|
commitdiff
2010-09-15
Sander Pronk
More scheduler-friendly locks for gmxfio
tree
|
commitdiff
2010-09-10
Berk Hess
made sure the energy history from a checkpoint file...
tree
|
commitdiff
2010-09-09
Berk Hess
added SSE overflow check for TPI
tree
|
commitdiff
2010-09-09
Gerrit Groenhof
added environment variable to run orca in parallel
tree
|
commitdiff
2010-09-03
Sander Pronk
Added missing windows thread files to distribution...
tree
|
commitdiff
2010-09-01
Erik Lindahl
Added Gerrit to the list of authors. Sorry for forgetti...
tree
|
commitdiff
2010-09-01
Sander Pronk
Added support for PGI atomics in thread_mpi.
tree
|
commitdiff
2010-09-01
Sander Pronk
Final thread_mpi fixes (ppc works, no deadlocks on...
tree
|
commitdiff
2010-08-31
Rossen Apostolov
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
|
commitdiff
2010-08-31
Erik Lindahl
Added final newline to avoid compiler warning in sfactor.h
tree
|
commitdiff
2010-08-31
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
|
commitdiff
2010-08-31
Sander Pronk
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
|
commitdiff
2010-08-31
Sander Pronk
Fixed memory ordering issue on ppc with gcc&xlc.
tree
|
commitdiff
2010-08-31
Szilard Pall
Merge branch 'release-4-5-patches' of git://git.gromacs...
tree
|
commitdiff
2010-08-31
Sander Pronk
thread_mpi fixes: gcc works on power7, xlc still does...
tree
|
commitdiff
2010-08-30
Teemu Murtola
Cosmetic fix to include/CMakeLists.txt.
tree
|
commitdiff
2010-08-29
Sander Pronk
Made the dhdl_derivatives option do something when...
tree
|
commitdiff
2010-08-27
Erik Lindahl
Added longer list of authors...
tree
|
commitdiff
2010-08-27
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
|
commitdiff
2010-08-27
Christoph Junghans
added a missing include to sighandler.h
tree
|
commitdiff
2010-08-26
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
|
commitdiff
2010-08-26
Erik Lindahl
Modified pdb2gmx to automatically pick the force field...
tree
|
commitdiff
2010-08-26
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
|
commitdiff
2010-08-26
Erik Lindahl
true/false input settings should be called bool instead...
tree
|
commitdiff
2010-08-26
Sander Pronk
Free energy writing to ener.edr and four new options...
tree
|
commitdiff
2010-08-26
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
|
commitdiff
2010-08-26
Erik Lindahl
Revert "Made pdb2gmx be slightly more helpful when...
tree
|
commitdiff
2010-08-25
Erik Lindahl
Fixed include path in vmdio.h
tree
|
commitdiff
2010-08-25
Erik Lindahl
Forgot to actually do the char->int change...
tree
|
commitdiff
2010-08-25
Erik Lindahl
Changed bool to signed integer instead of unsigned...
tree
|
commitdiff
2010-08-25
Rossen Apostolov
Redefine the default boolean type to gmx_bool.
tree
|
commitdiff
2010-08-25
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
|
commitdiff
2010-08-25
Mark Abraham
Made pdb2gmx be slightly more helpful when using AMBER...
tree
|
commitdiff
2010-08-24
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
|
commitdiff
2010-08-24
Sander Pronk
Another try with xlc/ppc atomics..
tree
|
commitdiff
2010-08-24
Berk Hess
fixed pdb2gmx behavior for nearly matching residue...
tree
|
commitdiff
2010-08-23
Sander Pronk
Modified memory barrier on ppc/xlc.
tree
|
commitdiff
2010-08-23
Sander Pronk
Enabled gcc atomic intrinsics for gcc on ppc.
tree
|
commitdiff
2010-08-23
Sander Pronk
More xlc ppc changes to thread_mpi
tree
|
commitdiff
2010-08-23
Christoph Junghans
fixed 2 typos in headers
tree
|
commitdiff
2010-08-23
Rossen Apostolov
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
|
commitdiff
2010-08-23
Berk Hess
removed the pdb2gmx -cwd option and updated the pdb2gmx...
tree
|
commitdiff
2010-08-23
Berk Hess
pdb2gmx now prints the force field dir before the selec...
tree
|
commitdiff
2010-08-23
Sander Pronk
Completely removed all occurrences of 'inline' for...
tree
|
commitdiff
2010-08-22
Erik Lindahl
Replaced all occurences of str(n)casecmp with gmx_str...
tree
|
commitdiff
2010-08-22
Erik Lindahl
Fixed a typo in futil.h
tree
|
commitdiff
2010-08-22
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
|
commitdiff
2010-08-22
Erik Lindahl
Cleaned up all installed headers to remove strict depen...
tree
|
commitdiff
2010-08-22
Erik Lindahl
Removed some unnecessary #ifdefs from string2.h; all...
tree
|
commitdiff
next