Adding energy output field for density fitting
[alexxy/gromacs.git] / src / gromacs / mdlib / tests / energyoutput.cpp
2019-09-06 Christian BlauAdding energy output field for density fitting
2019-08-23 Mark AbrahamUpdate clang-tidy to clang version 8
2019-08-22 Mark AbrahamMerge branch release-2019
2019-08-12 Pascal MerzUse new setenv function for energyoutput test
2019-08-01 Paul BauerMerge release-2019 into master
2019-05-24 Artem ZhmurovClarify the EnergyOutput III
2019-05-24 Artem ZhmurovClarify the EnergyOutput II
2019-05-03 Paul BauerReplace t_grps with std::vector
2019-05-03 Berk HessConvert manage_threading_t and gmx_enerdata_t to C++
2019-05-02 Artem ZhmurovUse test with parameters for EnergyOutput
2019-04-25 Artem ZhmurovImprovements for energy output test.
2019-04-18 Mark AbrahamMove pull work struct out of inputrec
2019-03-02 Mark AbrahamMerge branch release-2019
2019-02-20 Paul BauerMerge branch 'release-2019' into master
2019-02-13 Mark AbrahamMake EnergyOutput wrapper class