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Update copyright statements and change license to LGPL
[alexxy/gromacs.git]
/
src
/
mdlib
/
ewald.c
2012-11-29
Mark Abraham
Update copyright statements and change license to LGPL
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2011-01-30
David van der Spoel
Merge branch 'release-4-5-patches' into orderparm
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2010-08-25
Rossen Apostolov
Redefine the default boolean type to gmx_bool.
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2010-07-30
Erik Lindahl
Merge branch 'master' of git.gromacs.org:gromacs
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2010-07-30
Berk
commented out nthreads and threadid in t_commrec to...
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2010-06-27
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2010-06-24
Szilard Pall
Merge branch 'master' of git@git.gromacs.org:gromacs
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2010-06-24
Berk Hess
removed obsolete fftgrid code and disabled PPPM with...
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2010-06-18
Gerrit Groenhof
Merge branch 'master' into qmmm
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2010-06-17
Maarten Wolf
Merge branch 'master' of git@git.gromacs.org:gromacs
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2010-06-17
Szilard Pall
Merge branch 'master' of git@git.gromacs.org:gromacs
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2010-06-11
Sander Pronk
Fixed another batch of // comments.
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2010-03-02
Roland Schulz
Merge branch 'release-4-0-patches'
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2010-01-05
Roland Schulz
Undo Michael's accidental commits with:
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2010-01-04
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-27
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-27
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-23
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-20
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-19
Michael Shirts
Committing to merge
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2009-09-14
David van der Spoel
Merge branch 'master' of git.gromacs.org:gromacs
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2009-09-09
Michael Shirts
Merge branch 'master' of git://git.gromacs.org/gromacs
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2009-09-09
Erik Lindahl
Merge branch 'master' of git.gromacs.org:gromacs
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2009-09-02
David van der Spoel
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-09-01
Sander Pronk
Made PME work with MPI again.
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2009-08-30
kasson
Tool merge
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2009-08-27
David van der Spoel
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-08-21
Sander Pronk
Merge branch 'thread_mpi'. Threads should work for...
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2009-08-19
Sander Pronk
Ewald now thread-safe (and fails in the same binary...
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2009-08-17
Rossen Apostolov
Fixed incorrect scaling of forces in reciprocal space...
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2009-06-25
Sander Pronk
Merge branch 'thread_mpi' of git@git.gromacs.org:gromac...
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2009-06-25
Sander Pronk
Fixed many thread-unsafe bits of code; only gmx_wallcyc...
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2009-06-24
Sander Pronk
Merge branch 'thread_mpi' of git@git.gromacs.org:gromac...
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2009-06-24
Sander Pronk
Many thread-safety fixes in mdlib; better error reporti...
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2009-06-04
Erik Lindahl
Removed Id tags from master branch since they will...
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2007-06-13
lindahl
Reverted out the multilambda supported committed yesterday.
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2007-06-12
lindahl
Initial multilambda support added, i.e. we can now...
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2007-01-02
hess
removed the nsb struct and moved all the particle decom...
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2006-04-19
lindahl
fatal.h clashes with system headers on AIX. Renamed...
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2006-01-03
spoel
Did a large clean up of unused functions etc.
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2005-02-08
hess
fixed an error in the Ewald forces with free-energy=yes
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2005-01-12
hess
Added missing term epsilon_r to the Ewald and PME algor...
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2004-11-01
hess
implemented free-energy for Ewald and PME
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2004-09-06
spoel
Replaced the fatal_error routine by a more flexible...
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2004-08-23
hess
Removed the static data in pbc_dx by adding a t_pbc...
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2004-01-23
lindahl
Added conditional inclusion of config.h to source files.
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2003-11-17
spoel
Upped the version to 3.2.0
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2002-11-06
lindahl
Partial commit of the project to remove all static...
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2002-02-28
spoel
Renamed pull-internal.h to pull_internal.h
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2002-02-27
hess
removed my incorrect pme/ewald fe implementation
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2002-02-27
hess
Ewald now calculates the free energy contribution
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2001-07-09
lindahl
Fixed compile-time warnings and errors on some platform...
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2001-05-14
lindahl
Tagged files with gromacs 3.0 header
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2000-09-14
hess
Committed the new innerloops for Erik Lindahl
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1999-11-03
hess
copyrgted
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1999-11-02
lindahl
Moved calc_ewaldcoeff to gmxlib/ewald_util
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1999-11-01
lindahl
Changed include headers to accomodate the split of...
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1999-08-24
lindahl
Added initializers to remove compiler warnings
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1999-07-26
lindahl
Code for ordinary, slow, ewald electrostatics
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1999-05-14
hess
moved from gmxlib to mdlib
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biod.pnpi.spb.ru / alexxy / gromacs.git / history