Searched refs:cAtomInfoPlanar (Results 1 – 8 of 8) sorted by relevance
82 case cAtomInfoPlanar: return 2; // C2 Carbon - sp2 in getMacroModelAtomType()91 case cAtomInfoPlanar: return 15; // O2 Oxygen - double bond in getMacroModelAtomType()99 case cAtomInfoPlanar: in getMacroModelAtomType()117 case cAtomInfoPlanar: return 101; // S2 Sulfur - sp2 in getMacroModelAtomType()130 case cAtomInfoPlanar: return 54; // B2 Boron - sp2 in getMacroModelAtomType()
129 case cAtomInfoPlanar: in getMOL2Type()144 case cAtomInfoPlanar: in getMOL2Type()162 case cAtomInfoPlanar: return "O.2"; in getMOL2Type()173 case cAtomInfoPlanar: return "S.2"; in getMOL2Type()
1458 case cAtomInfoPlanar: in AtomInfoGetBondLength()1529 case cAtomInfoPlanar: /* planer carbon ============= */ in AtomInfoGetBondLength()1565 case cAtomInfoPlanar: in AtomInfoGetBondLength()1662 if((a1->geom == cAtomInfoPlanar) && (a2->geom == cAtomInfoPlanar)) in AtomInfoGetBondLength()1698 if((a1->geom == cAtomInfoPlanar) && (a2->geom == cAtomInfoPlanar)) in AtomInfoGetBondLength()1709 } else if(a1->geom == cAtomInfoPlanar) { in AtomInfoGetBondLength()1758 case cAtomInfoPlanar: in AtomInfoGetBondLength()1769 case cAtomInfoPlanar: in AtomInfoGetBondLength()
63 if (I->AtomInfo[atm].geom != cAtomInfoPlanar) in get_planer_normal_cs()212 case cAtomInfoPlanar: in ObjectMoleculeSetMissingNeighborCoords()
3689 case cAtomInfoPlanar: in get_planer_normal()3792 case cAtomInfoPlanar: in ObjectMoleculeFindOpenValenceVector()3842 case cAtomInfoPlanar: in ObjectMoleculeFindOpenValenceVector()4736 result = cAtomInfoPlanar; in ObjectMoleculeGetAtomGeometry()5691 if(ai->geom == cAtomInfoPlanar) in ObjectMoleculeInferChemForProtein()5822 carbonVal[cAtomInfoPlanar] = 3; in ObjectMoleculeInferChemFromNeighGeom()5884 if(geom == cAtomInfoPlanar) { in ObjectMoleculeInferChemFromNeighGeom()5886 ai->geom = cAtomInfoPlanar; in ObjectMoleculeInferChemFromNeighGeom()6177 ai0->geom = cAtomInfoPlanar; in ObjectMoleculeInferChemFromBonds()6178 ai1->geom = cAtomInfoPlanar; in ObjectMoleculeInferChemFromBonds()[all …]
121 #define cAtomInfoPlanar 3 macro
442 planar[a] = (ai->geom == cAtomInfoPlanar); in SculptMeasureObject()
198 if(ai->geom == cAtomInfoPlanar) { in populate_other()