cogIndices_.reserve(globalAtomIndices.size());
int moleculeBlock = 0;
- for (int localAtom = localAtomBegin; localAtom < globalAtomIndices.ssize(); localAtom++)
+ for (gmx::index localAtom = localAtomBegin; localAtom < globalAtomIndices.ssize(); localAtom++)
{
const int globalAtom = globalAtomIndices[localAtom];
int moleculeIndex;