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Merge branch 'master' of git.gromacs.org:gromacs
[alexxy/gromacs.git]
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share
/
2010-10-05
Szilard Pall
Merge branch 'master' of git.gromacs.org:gromacs
tree
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commitdiff
2010-09-30
Roland Schulz
Merge branch 'release-4-5-patches'
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commitdiff
2010-09-25
David van der Spoel
Merge branch 'release-4-5-patches'
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commitdiff
2010-09-25
David van der Spoel
Added software-related quote
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commitdiff
2010-09-25
Berk Hess
fixed case of opls atom types in share/top/ions.itp...
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commitdiff
2010-09-22
Roland Shulz
MCH3S was missing
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commitdiff
2010-09-20
David van der Spoel
Merge branch 'master' of git@git.gromacs.org:gromacs
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commitdiff
2010-09-20
David van der Spoel
Merge branch 'release-4-5-patches'
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commitdiff
2010-09-20
Per Larsson
Changes to GB non-polar solvation calculations
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commitdiff
2010-09-16
David van der Spoel
Merge branch 'release-4-5-patches'
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commitdiff
2010-09-16
Pär Bjelkmar
Merge branch 'release-4-5-patches' of git://git.gromacs...
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commitdiff
2010-09-16
Pär Bjelkmar
Atom-based charge groups in CHARMM.
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commitdiff
2010-09-14
David van der Spoel
Merge branch 'release-4-5-patches'
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commitdiff
2010-09-14
Mark Abraham
Formatting fixes to documentation
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commitdiff
2010-09-12
David van der Spoel
Fixed demo to work with new pdb2gmx that requires two...
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commitdiff
2010-09-10
Szilard Pall
Merge branch 'master' of git.gromacs.org:gromacs
tree
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commitdiff
2010-09-10
Szilard Pall
Merge remote branch 'origin/release-4-5-patches'
tree
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commitdiff
2010-09-10
Berk Hess
removed tip5p from charmm27.ff/watermodels.dat, since...
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commitdiff
2010-09-09
Mark Abraham
Added TIP5p to CHARMM forcefield by analogy with AMBER0...
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commitdiff
2010-09-09
Szilard Pall
Merge branch 'master' of git.gromacs.org:gromacs
tree
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commitdiff
2010-09-08
Szilard Pall
Merge branch 'release-4-5-patches'
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commitdiff
2010-09-08
Per Larsson
Fixed atomtype H0 for GBSA in amber03
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commitdiff
2010-09-08
Berk Hess
added MCH3S atom type for Charmm for virtual sites...
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commitdiff
2010-09-07
Rossen Apostolov
Merge branch 'release-4-5-patches'
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commitdiff
2010-09-06
Szilard Pall
Merge branch 'release-4-5-patches'
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commitdiff
2010-09-02
Rossen Apostolov
Another missing CMake file.
tree
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commitdiff
2010-09-02
Rossen Apostolov
Merge branch 'release-4-5-patches'
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commitdiff
2010-09-01
Mark Abraham
Formatting fixes to documentation
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commitdiff
2010-09-01
Mark Abraham
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
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commitdiff
2010-09-01
Mark Abraham
make_opt.html now doesn't use <h4>, rather it uses...
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commitdiff
2010-09-01
Mark Abraham
General fixes
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commitdiff
2010-08-31
Christoph Junghans
Revert "Disabled building template because it does...
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commitdiff
2010-08-31
Erik Lindahl
Moved buggy and unsupported g_sdf to contrib directory...
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commitdiff
2010-08-30
David van der Spoel
Merge branch 'release-4-5-patches'
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commitdiff
2010-08-30
David van der Spoel
Added one quote.
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commitdiff
2010-08-30
Christoph Junghans
fixed Template.mak
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commitdiff
2010-08-27
Erik Lindahl
Merge branch 'release-4-5-patches'
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commitdiff
2010-08-27
Erik Lindahl
Resolved merge conflict in gmx_membed.c
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commitdiff
2010-08-27
Maarten Wolf
Merge branch 'master' of git@git.gromacs.org:gromacs
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commitdiff
2010-08-27
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
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commitdiff
2010-08-27
David van der Spoel
Disabled building template because it does not compile !
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commitdiff
2010-08-27
Sander Pronk
Some documentation changes.
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commitdiff
2010-08-26
Sander Pronk
Free energy writing to ener.edr and four new options...
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commitdiff
2010-08-26
Mark Abraham
Made the description of ld_seed and gen_seed seed gener...
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commitdiff
2010-08-26
Christoph Junghans
Merge branch 'master' into HEAD
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commitdiff
2010-08-26
Christoph Junghans
Merge again the 4.5 head of 2010 Aug 23
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commitdiff
2010-08-26
Erik Lindahl
Updated html documentation for release 4.5
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commitdiff
2010-08-26
Christoph Junghans
Revertiing my fake merge to make history consistent
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commitdiff
2010-08-26
Mark Abraham
Fixed HTML documentation to use proper '&ge', not ...
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commitdiff
2010-08-26
Mark Abraham
Clarified documentation about when gen_vel generates...
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commitdiff
2010-08-25
Rossen Apostolov
Merge branch 'release-4-5-patches'
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commitdiff
2010-08-25
Rossen Apostolov
Redefine the default boolean type to gmx_bool.
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commitdiff
2010-08-25
David van der Spoel
Merge branch 'release-4-5-patches'
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commitdiff
2010-08-24
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
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commitdiff
2010-08-24
hess
added Amber terminal His rtp names to residuetypes.dat
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commitdiff
2010-08-24
hess
renamed oplsaa HISA to HISD and HISB to HISE in all...
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commitdiff
2010-08-23
Christoph Junghans
Merge branch 'release-4-5-patches'
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commitdiff
2010-08-23
Rossen Apostolov
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
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commitdiff
2010-08-23
Pär Bjelkmar
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
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commitdiff
2010-08-23
Pär Bjelkmar
Added CT3 termini and minor edit in doc file.
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commitdiff
2010-08-22
David van der Spoel
Merge branch 'release-4-5-patches'
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commitdiff
2010-08-22
Erik Lindahl
Amber force fields now pass validation. Beta status...
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commitdiff
2010-08-18
Michael Shirts
Merge branch 'release-4-5-patches' of git@git.gromacs...
tree
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commitdiff
2010-08-18
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
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commitdiff
2010-08-18
Erik Lindahl
Modified atom order in Amber nucleotide improper torsio...
tree
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commitdiff
2010-08-18
Erik Lindahl
Modified improper torsion atom order in Amber TRP resid...
tree
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commitdiff
2010-08-18
Christoph Junghans
Merge remote branch 'origin/release-4-5-patches'
tree
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commitdiff
2010-08-17
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
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commitdiff
2010-08-17
Michael Shirts
Merge branch 'release-4-5-patches' of git@git.gromacs...
tree
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commitdiff
2010-08-17
Christoph Junghans
Merge remote branch 'origin/release-4-5-patches'
tree
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commitdiff
2010-08-17
Christoph Junghans
split libs in Template.mak
tree
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commitdiff
2010-08-17
Christoph Junghans
make cmake install a CMakeLists.txt for the template...
tree
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commitdiff
2010-08-17
Roland Schulz
Merge remote branch 'origin/release-4-5-patches'
tree
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commitdiff
2010-08-13
Berk Hess
Merge remote branch 'origin/release-4-5-patches'
tree
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commitdiff
2010-08-11
Sander Pronk
Merge remote branch 'origin/release-4-5-patches'
tree
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commitdiff
2010-08-11
Berk Hess
Merge remote branch 'origin/release-4-5-patches'
tree
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commitdiff
2010-08-10
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
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commitdiff
2010-08-10
Berk Hess
removed CYS2 from the Amber rtp files
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commitdiff
2010-08-10
Peter Kasson
Merge branch 'master' of git@git.gromacs.org:gromacs
tree
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commitdiff
2010-08-08
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
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commitdiff
2010-08-08
Erik Lindahl
Added NHE as an Amber aminoacid residue type
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commitdiff
2010-08-08
Erik Lindahl
Copied CK-CB-N*-CT Amber improper to also list CK-CB...
tree
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commitdiff
2010-08-08
Berk
moved nstcalcenergy just before nstenergy in mdp, log...
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commitdiff
2010-08-06
Roland Schulz
Merge branch 'release-4-5-patches' of ssh://git.gromacs...
tree
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commitdiff
2010-08-06
Berk
removed + from opls NA ion in ions.tip, overlooked...
tree
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commitdiff
2010-08-06
Sander Pronk
Merge remote branch 'origin/release-4-5-patches'
tree
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commitdiff
2010-08-06
Berk Hess
Merge branch 'release-4-5-patches'
tree
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commitdiff
2010-08-06
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
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commitdiff
2010-08-05
Berk Hess
sc_sigma now also sets the minimum value for the soft...
tree
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commitdiff
2010-08-04
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
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commitdiff
2010-08-04
Berk Hess
grompp automatic nstcalcenergy setting now takes small...
tree
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commitdiff
2010-08-04
Rossen Apostolov
Fix share/html/online/mdp_opt.html.
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commitdiff
2010-08-04
David van der Spoel
Merge branch 'release-4-5-patches'
tree
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commitdiff
2010-08-03
Szilard Pall
Merge branch 'release-4-5-patches'
tree
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commitdiff
2010-08-03
Szilard Pall
Merge branch 'release-4-5-patches'
tree
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commitdiff
2010-08-03
David van der Spoel
Merge branch 'release-4-5-patches'
tree
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commitdiff
2010-08-03
David van der Spoel
Merge branch 'release-4-5-patches'
tree
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commitdiff
2010-08-02
Christoph Junghans
Merge remote branch 'origin/release-4-5-patches'
tree
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commitdiff
2010-08-02
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
tree
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commitdiff
2010-08-02
Erik Lindahl
Fixed build issue for template program in double precision
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commitdiff
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