Searched refs:CreateMOPacInternals (Results 1 – 5 of 5) sorted by relevance
207 void CreateMOPacInternals(long Num);
35 void Internals::CreateMOPacInternals(long Num) { in CreateMOPacInternals() function in Internals68 CreateMOPacInternals(3*MainData->GetMaximumAtomCount()); in WriteCoordinatesToFile()75 CreateMOPacInternals(3*MainData->GetMaximumAtomCount()); in WriteMPCZMatCoordinatesToFile()
753 IntCoords->CreateMOPacInternals(3*nAtoms); in ParseZMatrix()911 IntCoords->CreateMOPacInternals(3*atmCount); in ParseGAMESSUKZMatrix()1045 IntCoords->CreateMOPacInternals(3*nAtoms); in ParseMOPACZMatrix()
628 internals->CreateMOPacInternals(3*MainData->GetMaximumAtomCount()); in OnCoordchoice1Selected()
1632 MainData->IntCoords->CreateMOPacInternals(3*nAtoms); in OpenMOPACFile()