2013-10-17 |
Michael Shirts | Restarting from checkpoint no longer reinitializes... |
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2013-04-19 |
Teemu Murtola | Merge branch 'release-4-5-patches' |
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2013-03-26 |
Roland Schulz | Merge release-4-5-patches into release-4-6 |
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2013-02-20 |
Mark Abraham | Merge release-4-5-patches into release-4-6 |
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2013-01-22 |
Mark Abraham | Merge "added missing cleanup of some nbnxn_cuda data... |
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2013-01-18 |
Roland Schulz | Merge release-4-5-patches into release-4-6 |
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2013-01-18 |
Roland Schulz | Code beautification with uncrustify |
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2013-01-18 |
Mark Abraham | Fixing copyright issues and code contributors |
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2013-01-17 |
Mark Abraham | Merge branch 'release-4-5-patches' into release-4-6 |
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2013-01-11 |
Roland Schulz | Merge release-4-5-patches into release-4-6 |
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2012-11-29 |
Mark Abraham | Update copyright statements and change license to LGPL |
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2012-11-27 |
Roland Schulz | Add visibility defines |
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2012-11-26 |
Roland Schulz | Merge release-4-5-patches into release-4-6 |
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2012-11-20 |
Roland Schulz | Merge release-4-5-patches into release-4-6 |
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2012-11-03 |
Roland Schulz | Merge release-4-5-patches into release-4-6 |
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2012-10-02 |
Szilard Pall | added Verlet scheme and NxN non-bonded functionality |
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2012-10-01 |
Roland Schulz | Merge release-4-5-patches into release-4-6 |
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2012-09-03 |
Szilard Pall | Merge branch 'release-4-5-patches' into release-4-6 |
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2012-07-13 |
Roland Schulz | Merge release-4.5-patches into HEAD |
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2012-06-04 |
Michael Shirts | Merging in free energy, exp. ensemble, & andersen t... |
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2012-06-01 |
Roland Schulz | Merge release-4-5-patches into release-4-6 |
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2012-06-01 |
Christoph Junghans | Merge "Use External BLAS/LAPACK by default" into releas... |
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2012-05-24 |
Teemu Murtola | Merge "Code cleanup to avoid name collisions" into... |
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2012-05-17 |
Teemu Murtola | Merge "Fixing more clang warnings" into release-4-6 |
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2012-05-17 |
Maarten Wolf | mv membed.h from include to src/kernel |
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2011-05-06 |
David van der Spoel | Merge branch 'release-4-5-patches' of git@git.gromacs... |
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2011-05-05 |
Erik Lindahl | Merge branch 'release-4-5-patches' of git.gromacs.org... |
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2011-04-14 |
Mark Abraham | Moved iterated-constraints code into mdlib |
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2011-04-14 |
Mark Abraham | Moved heuristic neighbor-list code into mdlib |
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2011-04-14 |
Mark Abraham | Fixed code duplication |
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2011-01-30 |
David van der Spoel | Merge branch 'release-4-5-patches' into orderparm |
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2010-09-10 |
Berk Hess | made sure the energy history from a checkpoint file... |
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2010-08-25 |
Rossen Apostolov | Redefine the default boolean type to gmx_bool. |
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2010-08-23 |
Rossen Apostolov | Merge branch 'release-4-5-patches' of git.gromacs.org... |
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2010-08-22 |
Erik Lindahl | Merge branch 'release-4-5-patches' of git.gromacs.org... |
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2010-08-22 |
Erik Lindahl | Cleaned up all installed headers to remove strict depen... |
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2010-07-27 |
Erik Lindahl | Modified PDB io code to merely store the chain _identif... |
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2010-07-22 |
Christoph Junghans | fixed some include typos in headers |
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2010-07-10 |
Michael Shirts | Fixed minor formatting conflict. |
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2010-07-05 |
Maarten Wolf | Merge branch 'master' of git@git.gromacs.org:gromacs |
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2010-07-05 |
Sander Pronk | Fixed header files to be able to link 3d party code... |
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2010-06-09 |
Gerrit Groenhof | Merge branch 'master' into qmmm |
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2010-05-16 |
David van der Spoel | Merge branch 'master' of git@git.gromacs.org:gromacs |
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2010-05-07 |
Szilard Pall | Merge branch 'master' of git@git.gromacs.org:gromacs |
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2010-05-07 |
Berk Hess | Merge commit 'origin/2dpme' |
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2010-05-03 |
Berk Hess | added some explanation |
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2010-04-27 |
Berk Hess | resolved merge conflicts |
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2010-04-06 |
David van der Spoel | Revert "Added argument rtpname to t_atoms_set_resinfo... |
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2010-04-06 |
David van der Spoel | Added argument rtpname to t_atoms_set_resinfo to avoid... |
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2010-03-12 |
David van der Spoel | Merge branch 'master' of git.gromacs.org:gromacs |
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2010-03-11 |
Berk Hess | Merge branch 'master' of git@git.gromacs.org:gromacs |
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2010-03-11 |
David van der Spoel | Aded function copy_t_atoms, updated function add_t_atom... |
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2010-03-02 |
Roland Schulz | Merge branch 'release-4-0-patches' |
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2010-02-14 |
David van der Spoel | Added function to increase the array sizes in a t_atoms... |
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2010-02-09 |
David van der Spoel | Merge branch 'master' of git@git.gromacs.org:gromacs |
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2010-02-08 |
Berk Hess | introduced STEPSTRSIZE for printing gmx_large_int_t |
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2010-01-19 |
David van der Spoel | Merge branch 'master' of git@git.gromacs.org:gromacs |
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2010-01-13 |
Carsten Kutzner | Merge branch 'master' of git@git.gromacs.org:gromacs |
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2010-01-11 |
Michael Shirts | changes the nnhchains name to nhchainlength |
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2010-01-11 |
Michael Shirts | Merge branch 'master' of git://git.gromacs.org/gromacs |
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2010-01-11 |
Berk Hess | made separate arrays for NH pressure variables |
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2010-01-07 |
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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2009-12-21 |
David van der Spoel | 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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2009-12-20 |
Michael Shirts | Merge branch 'master' of git@git.gromacs.org:gromacs |
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2009-12-20 |
Michael Shirts | Fixed an issue with checkpointing not getting the first... |
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2009-12-05 |
Michael Shirts | Merge branch 'master' of git@git.gromacs.org:gromacs |
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2009-11-30 |
David van der Spoel | Merge branch 'master' of git@git.gromacs.org:gromacs |
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2009-11-27 |
Roland Schulz | Merge branch 'master' of git@git.gromacs.org:gromacs |
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2009-11-27 |
Sander Pronk | C++ fixes: fixed 'extern "C"' in header files m-z. |
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2009-09-14 |
David van der Spoel | Merge branch 'master' of git@git.gromacs.org:gromacs |
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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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2009-09-07 |
Roland Schulz | renamed gmx_step_t to gmx_large_int_t. gmx_large_int_t... |
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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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2009-07-16 |
Peter Kasson | Merge branch 'master' of git@git.gromacs.org:gromacs |
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2009-07-16 |
kasson | PK all instances of CPLUSPLUS #define changed to standa... |
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2009-07-14 |
Berk Hess | added mdp parameters nstcalcenergy and rlistlong and... |
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2009-06-30 |
Sander Pronk | added output_env_t type for querying time scales, and... |
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2009-06-04 |
Erik Lindahl | Removed Id tags from master branch since they will... |
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2009-06-03 |
lindahl | Fixed warnings when GNU C++ 4.3 is used. |
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2009-06-03 |
teemu | Improved compilation (no errors, less warnings) of... |
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2009-04-21 |
lindahl | Initial CMAP support commit. |
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2009-03-06 |
hess | added t_resinfo struct to t_atoms which contains the... |
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2009-02-02 |
hess | changed most step count variables from int to gmx_step_t |
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2008-09-19 |
lindahl | Implemented automatic renaming and optional appending... |
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2008-08-05 |
hess | t_topology is now partially replaced by gmx_mtop_t... |
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2008-07-01 |
carsten | Removed types/edsams.h from the includes list, since... |
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2008-02-14 |
hess | added two missing declarations |
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2008-02-13 |
hess | implemented box shape preservation for (semi)isotropic... |
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2008-02-02 |
hess | removed a array from t_block for cgs and mols, renamed... |
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2007-11-16 |
hess | made the shell code compatible with domain decompositio... |
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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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2007-05-21 |
hess | fixed slow memory reallocation, especially at the start... |
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2007-03-30 |
hess | complete rewrite of the pull code, now works in paralle... |
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