Refactor ResidueTypes
authorPaul Bauer <paul.bauer.q@gmail.com>
Mon, 7 Jan 2019 14:46:06 +0000 (15:46 +0100)
committerMark Abraham <mark.j.abraham@gmail.com>
Mon, 21 Jan 2019 10:13:15 +0000 (11:13 +0100)
commit89b033970efb44198b207f84502c69778a5ba638
tree1bf75915acb51a384251c5ac8f94ee5fe14cfc8e
parent2f9e9799983deb0ae36980e2eb82cb260f08458a
Refactor ResidueTypes

Changed datastructures to C++.
Replaced raw pointers with std::vector and std::string.
Removed unused function in residuetypes.h.

Change-Id: Idb4a5a879545a5de26b13bb8b484cd3debd6fba2
src/gromacs/fileio/pdbio.cpp
src/gromacs/gmxana/gmx_chi.cpp
src/gromacs/gmxpreprocess/gen_vsite.cpp
src/gromacs/gmxpreprocess/pdb2gmx.cpp
src/gromacs/topology/atomprop.cpp
src/gromacs/topology/index.cpp
src/gromacs/topology/residuetypes.cpp
src/gromacs/topology/residuetypes.h