replace string compare with enums, fix memory leak, formatting cleanup
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- src/compute_coord_atom.cpp 63 additions, 64 deletionssrc/compute_coord_atom.cpp
- src/compute_coord_atom.h 3 additions, 2 deletionssrc/compute_coord_atom.h
- src/compute_orientorder_atom.cpp 79 additions, 71 deletionssrc/compute_orientorder_atom.cpp
- src/compute_orientorder_atom.h 1 addition, 1 deletionsrc/compute_orientorder_atom.h
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