Add function to get residue start and end
commitb7b2422ea1cd87552d2870d7b6a2147f0cac1e85
authorPaul Bauer <paul.bauer.q@gmail.com>
Tue, 2 Jun 2020 09:33:05 +0000 (2 09:33 +0000)
committerPaul Bauer <paul.bauer.q@gmail.com>
Tue, 2 Jun 2020 09:33:05 +0000 (2 09:33 +0000)
tree3652d3ee1232e9d20afbd5d7ad02e62fced5fff3
parent83525170216a88efaa8c2e7e57640aaab1bd12d4
Add function to get residue start and end

Free function for mtop that makes it possible to obtain the start and
end point of residues in a molecule block.

Change-Id: Ic7ac4b79a29275aac65cd8224f163e3c2efe6d4d
src/gromacs/topology/mtop_util.cpp
src/gromacs/topology/mtop_util.h
src/gromacs/topology/tests/mtop.cpp