BioD PNPI Git Repos - alexxy/gromacs.git/history - src/gromacs/domdec/domdec

biod.pnpi.spb.ru / alexxy / gromacs.git / history

[alexxy/gromacs.git] / src / gromacs / domdec / domdec_topology.cpp

2019-12-16	Berk Hess	Use ListOfLists in gmx_mtop_t and gmx_localtop_t	blob \| commitdiff \| raw
2019-12-12	Paul Bauer	Merge branch 'origin/release-2020' into master	blob \| commitdiff \| raw \| diff to current
2019-11-30	Paul Bauer	Merge origin/release-2020 into master	blob \| commitdiff \| raw \| diff to current
2019-11-29	Mark Abraham	Merge branch release-2019 into release-2020	blob \| commitdiff \| raw \| diff to current
2019-11-21	Mark Abraham	Merge branch release-2020	blob \| commitdiff \| raw \| diff to current
2019-11-20	Paul Bauer	Merge 'origin/release-2019' into release-2020	blob \| commitdiff \| raw \| diff to current
2019-11-18	Berk Hess	Fix intermolecular interactions with DD	blob \| commitdiff \| raw \| diff to current
2019-11-14	Berk Hess	Simplify t_forcerec destruction	blob \| commitdiff \| raw \| diff to current
2019-11-07	Paul Bauer	Apply clang-format to source tree	blob \| commitdiff \| raw \| diff to current
2019-10-29	Paul Bauer	Merge branch 'release-2019' into master	blob \| commitdiff \| raw \| diff to current
2019-10-01	Berk Hess	Use gmx::Range in domdec	blob \| commitdiff \| raw \| diff to current
2019-10-01	Berk Hess	Completely remove charge groups	blob \| commitdiff \| raw \| diff to current
2019-10-01	Berk Hess	Simplify DD exclusion counting	blob \| commitdiff \| raw \| diff to current
2019-09-27	Berk Hess	Extract gmx::Range	blob \| commitdiff \| raw \| diff to current
2019-09-25	Szilárd Páll	Merge remote-tracking branch 'origin/release-2019'	blob \| commitdiff \| raw \| diff to current
2019-09-24	Paul Bauer	Merge branch release-2019 into master	blob \| commitdiff \| raw \| diff to current
2019-09-19	Berk Hess	Remove bLocalCG from DD code	blob \| commitdiff \| raw \| diff to current
2019-09-19	Berk Hess	Remove obsolete make_exclusions_zone_cg()	blob \| commitdiff \| raw \| diff to current
2019-09-19	ejjordan	Remove or update comments containing 'group scheme'	blob \| commitdiff \| raw \| diff to current
2019-09-04	Berk Hess	Move constraint and bonded filtering info into DDSystemInfo	blob \| commitdiff \| raw \| diff to current
2019-08-22	Mark Abraham	Merge branch release-2019	blob \| commitdiff \| raw \| diff to current
2019-08-20	Mark Abraham	Apply clang-tidy-8 readability-uppercase-literal-suffix	blob \| commitdiff \| raw \| diff to current
2019-08-16	Mark Abraham	Update testing matrices and fix warnings	blob \| commitdiff \| raw \| diff to current
2019-08-01	Paul Bauer	Merge release-2019 into master	blob \| commitdiff \| raw \| diff to current
2019-07-11	Pascal Merz	Remove dependence of compute_globals on t_state	blob \| commitdiff \| raw \| diff to current
2019-07-02	Kevin Boyd	Remove references to ecutsGROUP	blob \| commitdiff \| raw \| diff to current
2019-06-14	Paul Bauer	Merge branch release-2018 into release-2019	blob \| commitdiff \| raw \| diff to current
2019-04-18	Berk Hess	Remove charge groups from domdec and localtop	blob \| commitdiff \| raw \| diff to current
2019-04-17	Berk Hess	Simplify vsite PBC handling	blob \| commitdiff \| raw \| diff to current
2019-03-02	Mark Abraham	Merge branch release-2019	blob \| commitdiff \| raw \| diff to current
2019-02-20	Paul Bauer	Merge branch 'release-2019' into master	blob \| commitdiff \| raw \| diff to current
2019-02-11	Roland Schulz	Remove EmptyArrayRef	blob \| commitdiff \| raw \| diff to current
2019-02-07	Roland Schulz	Revert size to be unsigned for ArrayRef	blob \| commitdiff \| raw \| diff to current
2019-02-07	Roland Schulz	Add ssize and remove static_casts	blob \| commitdiff \| raw \| diff to current
2019-02-04	Roland Schulz	Replace compat::make_unique with std::make_unique	blob \| commitdiff \| raw \| diff to current
2019-01-30	Mark Abraham	Merge remote branch release-2018 into release-2019	blob \| commitdiff \| raw \| diff to current
2019-01-23	Roland Schulz	Merge release-2019 into master	blob \| commitdiff \| raw \| diff to current
2019-01-23	Roland Schulz	Merge release-2018 into release-2019	blob \| commitdiff \| raw \| diff to current
2019-01-09	Paul Bauer	Fix uncrustify complaining about files	blob \| commitdiff \| raw \| diff to current
2019-01-04	Paul Bauer	Change gmx_localtop_t to C++	blob \| commitdiff \| raw \| diff to current
2018-12-31	Paul Bauer	Merge branch release-2018 into release-2019	blob \| commitdiff \| raw \| diff to current
2018-12-17	Paul Bauer	Merge branch release-2018 into release-2019	blob \| commitdiff \| raw \| diff to current
2018-11-21	Paul Bauer	Merge branch release-2018 into release-2019	blob \| commitdiff \| raw \| diff to current
2018-11-20	Mark Abraham	Merge "Merge release-2019 into master"	blob \| commitdiff \| raw \| diff to current
2018-11-16	Roland Schulz	Merge release-2019 into master	blob \| commitdiff \| raw \| diff to current
2018-11-01	Berk Hess	Fix broken update groups	blob \| commitdiff \| raw \| diff to current
2018-10-26	Mark Abraham	Merge branch release-2018 into release-2019	blob \| commitdiff \| raw \| diff to current
2018-10-13	Viacheslav Bolnykh	Updated name of intemolecular exclusions function	blob \| commitdiff \| raw \| diff to current
2018-10-12	Viacheslav Bolnykh	Implemented QM/MM workflow inside core GROMACS	blob \| commitdiff \| raw \| diff to current
2018-10-08	Berk Hess	Enable update groups	blob \| commitdiff \| raw \| diff to current
2018-10-08	Mark Abraham	Implement PaddedVector	blob \| commitdiff \| raw \| diff to current
2018-10-02	Berk Hess	Update DD cutoffs for update groups	blob \| commitdiff \| raw \| diff to current
2018-09-22	Berk Hess	Rename DD constraint booleans	blob \| commitdiff \| raw \| diff to current
2018-09-21	Roland Schulz	Fix clang-tidy warnings for clang 7	blob \| commitdiff \| raw \| diff to current
2018-09-19	Berk Hess	Convert gmx_cmap_t to C++	blob \| commitdiff \| raw \| diff to current
2018-09-19	Berk Hess	Convert gmx_ffparams_t to C++	blob \| commitdiff \| raw \| diff to current
2018-09-18	Mark Abraham	Separated partitioning and dlb code within domdec	blob \| commitdiff \| raw \| diff to current
2018-09-17	Berk Hess	Change pointers to InteractionList to references	blob \| commitdiff \| raw \| diff to current
2018-09-14	Berk Hess	Change gmx_moltype_t.ilist to InteractionLists	blob \| commitdiff \| raw \| diff to current
2018-09-13	Berk Hess	Add C++ version of t_ilist	blob \| commitdiff \| raw \| diff to current
2018-09-12	Berk Hess	Convert vsite structs to C++	blob \| commitdiff \| raw \| diff to current
2018-09-12	Berk Hess	Convert DD gmx_reverse_top_t to C++	blob \| commitdiff \| raw \| diff to current
2018-09-11	Mark Abraham	Improve DD logging	blob \| commitdiff \| raw \| diff to current
2018-09-11	Pascal Merz	Added trivial const qualifiers	blob \| commitdiff \| raw \| diff to current
2018-08-29	Mark Abraham	Merge branch release-2018	blob \| commitdiff \| raw \| diff to current
2018-08-24	Mark Abraham	Merge branch release-2018	blob \| commitdiff \| raw \| diff to current
2018-08-20	Berk Hess	Make gmx_ga2la_t a proper class	blob \| commitdiff \| raw \| diff to current
2018-08-18	Roland Schulz	readability-implicit-bool-conversion 2/2	blob \| commitdiff \| raw \| diff to current
2018-08-18	Roland Schulz	clang-tidy modernize	blob \| commitdiff \| raw \| diff to current
2018-08-06	Roland Schulz	Change gmx_bool from int to bool	blob \| commitdiff \| raw \| diff to current
2018-07-16	Roland Schulz	Warn for type mismatch for gmx printf like functions 1/3	blob \| commitdiff \| raw \| diff to current
2018-07-04	Roland Schulz	Merge release-2018 into master	blob \| commitdiff \| raw \| diff to current
2018-07-01	Roland Schulz	clang-tidy: readability-non-const-parameter (2/2)	blob \| commitdiff \| raw \| diff to current
2018-06-28	Berk Hess	Rename atomGroups in gmx_domdec_t to atomGrouping	blob \| commitdiff \| raw \| diff to current
2018-06-28	Berk Hess	Change BlockRanges to class RangePartitioning	blob \| commitdiff \| raw \| diff to current
2018-06-13	Berk Hess	Partial conversion of gmx_domdec_t to C++	blob \| commitdiff \| raw \| diff to current
2018-05-25	Mark Abraham	Clean up force.h and its use	blob \| commitdiff \| raw \| diff to current
2018-05-03	Mark Abraham	Merge branch release-2018	blob \| commitdiff \| raw \| diff to current
2018-04-16	Berk Hess	Move natoms_mol out of gmx_molblock_t	blob \| commitdiff \| raw \| diff to current
2018-04-13	Mark Abraham	Merge branch release-2018	blob \| commitdiff \| raw \| diff to current
2018-04-09	Berk Hess	Convert gmx_molblock_t to C++	blob \| commitdiff \| raw \| diff to current
2018-04-04	Pascal Merz	Move checkNumberOfBondedInteractions	blob \| commitdiff \| raw \| diff to current
2018-04-03	Berk Hess	Convert gmx_mtop_t to C++	blob \| commitdiff \| raw \| diff to current
2018-03-28	Mark Abraham	Merge branch release-2018	blob \| commitdiff \| raw \| diff to current
2018-03-20	Mark Abraham	Merge branch release-2016 into release-2018	blob \| commitdiff \| raw \| diff to current
2018-03-06	Mark Abraham	Merge branch release-2018	blob \| commitdiff \| raw \| diff to current
2018-02-28	Mark Abraham	Reorganized constraint code	blob \| commitdiff \| raw \| diff to current
2018-02-27	Aleksei Iupinov	Merge branch 'release-2018'	blob \| commitdiff \| raw \| diff to current
2018-02-16	Mark Abraham	Merge branch release-2016 into release-2018	blob \| commitdiff \| raw \| diff to current
2018-02-16	Mark Abraham	Merge branch release-2018 into master	blob \| commitdiff \| raw \| diff to current
2018-02-14	Berk Hess	Remove support for tpx version before 58/gmx4.0	blob \| commitdiff \| raw \| diff to current
2018-02-14	Mark Abraham	Merge branch release-2016 into release-2018	blob \| commitdiff \| raw \| diff to current
2018-02-09	Mark Abraham	Merge branch release-2018	blob \| commitdiff \| raw \| diff to current
2018-02-08	Mark Abraham	Merge branch release-2016 into release-2018	blob \| commitdiff \| raw \| diff to current
2018-02-08	Aleksei Iupinov	Merge branch 'release-2018' into master	blob \| commitdiff \| raw \| diff to current
2018-02-06	Aleksei Iupinov	Remove unnecessary includes from domdec.h	blob \| commitdiff \| raw \| diff to current
2018-01-24	Mark Abraham	Remove gmx_inline	blob \| commitdiff \| raw \| diff to current
2018-01-09	Mark Abraham	Merge branch release-2016 into release-2018	blob \| commitdiff \| raw \| diff to current
2017-12-22	Mark Abraham	Merge branch release-2016 into release-2018	blob \| commitdiff \| raw \| diff to current
2017-12-21	Mark Abraham	Merge branch release-5-1 into release-2016	blob \| commitdiff \| raw \| diff to current
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