--- branches/development/src/brains/SimInfo.cpp 2010/10/02 20:41:53 1504 +++ branches/development/src/brains/SimInfo.cpp 2010/10/03 22:18:59 1505 @@ -761,7 +761,6 @@ namespace OpenMD { useSF = 0; useSP = 0; useBoxDipole = 0; - if (simParams_->haveElectrostaticSummationMethod()) { std::string myMethod = simParams_->getElectrostaticSummationMethod(); @@ -862,7 +861,6 @@ namespace OpenMD { MPI_Allreduce(&temp, &useAtomicVirial_, 1, MPI_INT, MPI_LOR, MPI_COMM_WORLD); #endif - fInfo_.SIM_uses_PBC = usePBC; fInfo_.SIM_uses_DirectionalAtoms = useDirectionalAtom; fInfo_.SIM_uses_LennardJones = useLennardJones; @@ -1472,7 +1470,7 @@ namespace OpenMD { [ Ixx -Ixy -Ixz ] - J =| -Iyx Iyy -Iyz | + J =| -Iyx Iyy -Iyz | [ -Izx -Iyz Izz ] */