Searched refs:GetSqrtAtomMass (Results 1 – 4 of 4) sorted by relevance
240 float lmass = 1.0/Prefs->GetSqrtAtomMass(lFrame->GetAtomType(iatom)-1); in ApplyOffset()
1768 lVibs->NormMode[i].x = Vector.x*Prefs->GetSqrtAtomMass(AtomType-1); in OpenXYZFile()1769 lVibs->NormMode[i].y = Vector.y*Prefs->GetSqrtAtomMass(AtomType-1); in OpenXYZFile()1770 lVibs->NormMode[i].z = Vector.z*Prefs->GetSqrtAtomMass(AtomType-1); in OpenXYZFile()1919 Mode1Vibs->NormMode[j].x = Vector.x*Prefs->GetSqrtAtomMass(AtomType-1); in OpenMolPltFile()1920 Mode1Vibs->NormMode[j].y = Vector.y*Prefs->GetSqrtAtomMass(AtomType-1); in OpenMolPltFile()1921 Mode1Vibs->NormMode[j].z = Vector.z*Prefs->GetSqrtAtomMass(AtomType-1); in OpenMolPltFile()2016 (lVibs->NormMode[catm]).x *= (Prefs->GetSqrtAtomMass((lFrame->Atoms[j].Type)-1)); in OpenMolPltFile()2017 (lVibs->NormMode[catm]).y *= (Prefs->GetSqrtAtomMass((lFrame->Atoms[j].Type)-1)); in OpenMolPltFile()2018 (lVibs->NormMode[catm]).z *= (Prefs->GetSqrtAtomMass((lFrame->Atoms[j].Type)-1)); in OpenMolPltFile()
486 inline float GetSqrtAtomMass(long AtomNum) const {return AtomMasses[AtomNum];}; in GetSqrtAtomMass() function
2429 float lmass = Prefs->GetSqrtAtomMass(Atoms[test].GetType()-1); in ParseNormalModes()2551 float lmass = Prefs->GetSqrtAtomMass(Atoms[j].GetType()-1); in ParseMolDenFrequencies()