BioD PNPI Git Repos - alexxy/gromacs.git/history - src/gromacs/gmxpreprocess/toppush.cpp

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

[alexxy/gromacs.git] / src / gromacs / gmxpreprocess / toppush.cpp

2021-10-18	Andrey Alekseenko	Merge release-2021 into master	blob \| commitdiff \| raw
2021-09-29	Eliane Briand	Relax requirement for bonded atom type names	blob \| commitdiff \| raw
2021-09-14	Andrey Alekseenko	Merge remote-tracking branch 'origin/release-2021'...	blob \| commitdiff \| raw \| diff to current
2021-08-19	Andrey Alekseenko	Merge remote-tracking branch 'origin/release-2021'...	blob \| commitdiff \| raw \| diff to current
2021-08-13	Dmitry Morozov	Fix MSVC error in toppush.cpp	blob \| commitdiff \| raw \| diff to current
2021-08-07	Mark Abraham	Avoid expensive atom-type lookups in grompp	blob \| commitdiff \| raw \| diff to current
2021-08-05	Mark Abraham	Lift atom type lookup out of inner loops	blob \| commitdiff \| raw \| diff to current
2021-07-30	Mark Abraham	Simplify short-circuit logic in grompp	blob \| commitdiff \| raw \| diff to current
2021-07-28	Mark Abraham	Optimize grompp VDW parameter-generation allocations	blob \| commitdiff \| raw \| diff to current
2021-07-02	Andrey Alekseenko	Avoid passing a temporary object to emplace_back	blob \| commitdiff \| raw \| diff to current
2021-06-29	Paul Bauer	Merge branch release-2021 into master	blob \| commitdiff \| raw \| diff to current
2021-06-18	Berk Hess	Speed up grompp LJ parameter generation	blob \| commitdiff \| raw \| diff to current
2021-05-07	Paul Bauer	Merge branch release-2021 into merge-2021-into-master	blob \| commitdiff \| raw \| diff to current
2021-03-22	Mark Abraham	Use StringToEnumValueConverter and enumValueToString...	blob \| commitdiff \| raw \| diff to current
2021-03-05	Mark Abraham	Introduce StringToEnumValue	blob \| commitdiff \| raw \| diff to current
2021-03-05	Paul Bauer	Merge branch release-2020 into merge-2020-into-2021	blob \| commitdiff \| raw \| diff to current
2021-03-02	Paul Bauer	Modernize atom enums	blob \| commitdiff \| raw \| diff to current
2021-03-02	Paul Bauer	Use optional instead of magic numbers in preprocessing	blob \| commitdiff \| raw \| diff to current
2021-02-22	Paul Bauer	Refactor md_enums	blob \| commitdiff \| raw \| diff to current
2021-02-12	Mark Abraham	Merge branch release-2021 into master	blob \| commitdiff \| raw \| diff to current
2021-02-03	Paul Bauer	Fix issues found by static analyzer	blob \| commitdiff \| raw \| diff to current
2021-01-29	Mark Abraham	Merge branch release-2021	blob \| commitdiff \| raw \| diff to current
2021-01-07	Paul Bauer	Merge branch release-2020 into merge-2020-into-2021	blob \| commitdiff \| raw \| diff to current
2020-12-18	Mark Abraham	Merge branch release-2021	blob \| commitdiff \| raw \| diff to current
2020-12-16	M. Eric Irrgang	Apply re-formatting to C++ in src/ tree.	blob \| commitdiff \| raw \| diff to current
2020-11-24	Paul Bauer	Merge branch 'origin/release-2020' into merge-2020...	blob \| commitdiff \| raw \| diff to current
2020-10-20	Paul Bauer	Merge branch 'origin/release-2020' into merge-release...	blob \| commitdiff \| raw \| diff to current
2020-10-07	Paul Bauer	Merge branch 'origin/release-2020' into merge-release...	blob \| commitdiff \| raw \| diff to current
2020-08-31	Paul Bauer	Merge branch 'release-2020' into master	blob \| commitdiff \| raw \| diff to current
2020-05-06	Paul Bauer	Merge branch 'origin/release-2020' into master	blob \| commitdiff \| raw \| diff to current
2020-03-04	Paul Bauer	Merge branch release-2020 into master	blob \| commitdiff \| raw \| diff to current
2020-02-28	Paul Bauer	Merge branch release-2019 into release-2020	blob \| commitdiff \| raw \| diff to current
2020-01-28	Paul Bauer	Merge branch origin/release-2020 into master	blob \| commitdiff \| raw \| diff to current
2020-01-09	Mark Abraham	Split lines with many copyright years	blob \| commitdiff \| raw \| diff to current
2020-01-08	Roland Schulz	Merge release-2019 into release-2020	blob \| commitdiff \| raw \| diff to current
2020-01-07	Paul Bauer	Merge branch origin/release-2020 into master	blob \| commitdiff \| raw \| diff to current
2020-01-07	Paul Bauer	Merge commit d30f2cb6 from release-2020 into master	blob \| commitdiff \| raw \| diff to current
2019-12-27	Paul Bauer	Merge origin/release-2019 into release-2020	blob \| commitdiff \| raw \| diff to current
2019-12-16	Berk Hess	Use ListOfLists in gmx_mtop_t and gmx_localtop_t	blob \| commitdiff \| raw \| diff to current
2019-11-29	Mark Abraham	Merge branch release-2019 into release-2020	blob \| commitdiff \| raw \| diff to current
2019-11-20	Paul Bauer	Merge 'origin/release-2019' into release-2020	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	Completely remove charge groups	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
2019-08-23	Mark Abraham	Update clang-tidy to clang version 8	blob \| commitdiff \| raw \| diff to current
2019-08-22	Mark Abraham	Merge branch release-2019	blob \| commitdiff \| raw \| diff to current
2019-08-01	Mark Abraham	Merge "Merge release-2019 into master"	blob \| commitdiff \| raw \| diff to current
2019-08-01	Paul Bauer	Merge release-2019 into master	blob \| commitdiff \| raw \| diff to current
2019-06-14	Paul Bauer	Merge branch release-2018 into release-2019	blob \| commitdiff \| raw \| diff to current
2019-04-23	Mark Abraham	Clarify pushing of interaction types	blob \| commitdiff \| raw \| diff to current
2019-04-16	Paul Bauer	Refactor t_pindex	blob \| commitdiff \| raw \| diff to current
2019-04-12	Mark Abraham	Improve warning messages about duplicate definitions	blob \| commitdiff \| raw \| diff to current
2019-04-02	Paul Bauer	Refactor gpp_bond_atomtype	blob \| commitdiff \| raw \| diff to current
2019-03-31	David van der Spoel	Removed confusing gpp_atomtype functions.	blob \| commitdiff \| raw \| diff to current
2019-03-28	Roland Schulz	Fix UB vector usage	blob \| commitdiff \| raw \| diff to current
2019-03-13	Paul Bauer	Refactor t_param to InteractionType	blob \| commitdiff \| raw \| diff to current
2019-03-08	Paul Bauer	Refactor preprocessing atom types.	blob \| commitdiff \| raw \| diff to current
2019-03-02	Mark Abraham	Merge branch release-2019	blob \| commitdiff \| raw \| diff to current
2019-02-27	Paul Bauer	Refactor t_params to InteractionTypeParameters	blob \| commitdiff \| raw \| diff to current
2019-02-25	Paul Bauer	Refactor ExclusionBlocks	blob \| commitdiff \| raw \| diff to current
2019-02-21	Paul Bauer	Refactor t_molinfo to MoleculeInformation class	blob \| commitdiff \| raw \| diff to current
2019-02-20	Paul Bauer	Merge branch 'release-2019' into master	blob \| commitdiff \| raw \| diff to current
2019-02-04	Roland Schulz	Rename all source files from - to _ for consistency.	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
2019-01-13	Mark Abraham	Improve use of gmxpreprocess headers	blob \| commitdiff \| raw \| diff to current
2019-01-11	Mark Abraham	Use enum class for grompp directives	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
2018-10-26	Mark Abraham	Merge branch release-2018 into release-2019	blob \| commitdiff \| raw \| diff to current
2018-10-15	Mark Abraham	Create ExclusionBlocks	blob \| commitdiff \| raw \| diff to current
2018-10-01	Mark Abraham	Fix gcc-8 warnings about strings	blob \| commitdiff \| raw \| diff to current
2018-09-10	Roland Schulz	Replace rounding using int(x+0.5) with roundToInt	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
2018-08-18	Roland Schulz	readability-implicit-bool-conversion 1/2	blob \| commitdiff \| raw \| diff to current
2018-08-18	Roland Schulz	clang-tidy modernize	blob \| commitdiff \| raw \| diff to current
2018-08-12	Roland Schulz	3/3 of old-style casting	blob \| commitdiff \| raw \| diff to current
2018-08-08	Roland Schulz	Fix part of old-style casting	blob \| commitdiff \| raw \| diff to current
2018-07-30	Joe Jordan	remove most debug flags from gmxpreprocess	blob \| commitdiff \| raw \| diff to current
2018-07-17	Joe Jordan	change gmx_bool to bool in gmxpreprocess	blob \| commitdiff \| raw \| diff to current
2018-07-04	Roland Schulz	Merge release-2018 into master	blob \| commitdiff \| raw \| diff to current
2018-07-03	Roland Schulz	clang-tidy: misc-misplaced-const	blob \| commitdiff \| raw \| diff to current
2018-06-28	Roland Schulz	clang-tidy: performance-type-promotion-in-math-fn	blob \| commitdiff \| raw \| diff to current
2018-06-23	Roland Schulz	Allow to enable clang-tidy with GMX_CLANG_TIDY	blob \| commitdiff \| raw \| diff to current
2018-05-03	Mark Abraham	Merge branch release-2018	blob \| commitdiff \| raw \| diff to current
2018-04-13	Mark Abraham	Merge branch release-2018	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
2018-02-27	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	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
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